09 Neurokinin2Neurokinin2NK2 Project Count vs NK2 pKi"NK2 card template>Phenyl piperazine card templateNeurokinin2VisualisationNeurokinin2/Neurokinin2ID%Kt7& Structure<Rule> <Rule> <Column></Column> <UserCreated>0</UserCreated> <RemoveSalts>1</RemoveSalts> <UseFileDiagramCoords>True</UseFileDiagramCoords> <CombineConformers>False</CombineConformers> </Rule> </Rule> #ǜLb{`Compound ID<Rule> <Rule> <Column></Column> <UserCreated>0</UserCreated> <ValueType>0</ValueType> <Value></Value> <IncrementStart>1</IncrementStart> <IncrementChange>1</IncrementChange> <Temporary>0</Temporary> </Rule> </Rule> aCnCJFNK2 pKi<RulesList> <Rule> <Column>NK2 pKi</Column> <UserCreated>1</UserCreated> <ValueType>0</ValueType> <Value></Value> <IncrementStart>1</IncrementStart> <IncrementChange>1</IncrementChange> <Temporary>0</Temporary> <Units>5</Units> <SDType>0</SDType> <SD>0.3</SD> <SDColumn></SDColumn> <RemoveColumn>0</RemoveColumn> <KeepOriginals>0</KeepOriginals> <UseValue>1</UseValue> <Precision>-1</Precision> <FloatingPointDisplay>Default</FloatingPointDisplay> </Rule> </RulesList> *jL)>Vz SeriesU<RulesList> <Rule> <Column>Series</Column> <UserCreated>0</UserCreated> <UseDefault>1</UseDefault> <Categories> <Category Index="0" Name="Phenyl piperazine"/> <Category Index="1" Name="Amide oxime"/> <Category Index="2" Name="Peptide urea"/> <Category Index="3" Name="Monobasic ether oxime"/> <Category Index="4" Name="Dibasic ether oxime"/> <Category Index="5" Name="Quinoline"/> <Category Index="6" Name="Singletons"/> </Categories> </Rule> </RulesList> i_/ A #ǜLb{` 50116745*jL)>VzAmide oxime?8aCnCJF@# Ơ?33@%Kt7& CON=C(CN(C)C(=O)C1=CC(=CC(=C1)Cl)Cl)C(CCN2CCC(CC2)N3CCCN(CC(N)=O)C3=O)C4=CC=C(Cl)C(=C4)Clg}qtK|Ow~ϟ*ﴷ?"x~ӻ9e׸cJ9Ҧ?/8/KjcϷH63 7.80673313 1.297662020?H64 7.80673313 2.082338090@H65 7.40820456 2.772609470AH66 6.8670630530BH67 5.25204945 2.772609470CH68 4.85352087 2.082338090DH69 4.85352087 1.29766190EH70 5.25204945 0.6073906420FH71 7.40820456 3.607390640GH72 7.80673313 4.297661780HH73 7.80673313 5.082338330IH74 7.40820456 5.772609230JH75 6.72865582 6.164947510KH76 5.93159914 6.164947510LH77 3.98749542 5.797661780MH784.386024 5.10739040NH79 3.19511509 6.880000110OH80 3.7320509 7.809999940PH81 8.92820358 -1.189999940QH82 10.3311644-20RH83 7.52524185 -3.62000012086                ! !" "##$#%#$&%'%&(&')'(*()+(*,*+-%+.*,/-0.1/20314253647 58 697:8;9<:=;><?=@>A?B@CADBECFDGEHFIGJHKILJMKNLOMP!NQ!OR&PS'QT+RUH00000000-0000-0000-0000-000000000000_EM(#ǜLb{` 50110673*jL)>VzAmide oxime?8aCnCJF@"Ơ?33@%Kt7& CN(CC(=NOCC(=N)NO)C(CCN1CCC(CC1)N2CCCCC2=O)C3=CC=C(Cl)C(=C3)Cl)C(=O)C4=CC(=CC(=C4)Cl)Clg}qv[|7vϿ+}㼷"z~|׿~s=ucJ9?{ݟ^&?>8T/K*Ͼ{H63 5.86262989 2.974947690?H64 5.06557369 2.974947690@H65 4.59807634 2.619999890AH66 3.98749542 1.107661840BH674.386024 0.4173905850CH68 5.06557369 0.02505244310DH69 5.86262989 0.02505244310EH70 2.46749711 1.525052430FH71 3.26455379 1.525052430GH72 1.3894192 2.607661960HH73 1.78794765 1.917390580IH74 1.78794765 4.082609650JH75 1.3894192 3.392338040KH76 3.26455379 4.474947450LH77 2.46749711 4.474947450MH78 9.46513939 -2.189999820NH79 9.46513939 -3.810000180OH80 6.6592164 -2.190000060PH81 11.52627941.380QH82 12.9292402 3.809999940RH83 10.1233187 3.80999994086           ! !"!# "$#%#$&#%'%&(&')'(*()+)*,%*-)+.',/-0.1/20314253647 58 69 7: 8; 9< := ;><?=@>A?B@CADBECFDGEHFIGJHKILJMKNLOMPNQ!OR&PS(QT*RUH00000000-0000-0000-0000-000000000000CIƈ0ۺ#ǜLb{` 50116733*jL)>VzAmide oxime?8aCnCJF@"Ơ?33@%Kt7& CON=C(CN(C)C(=O)C1=CC(=CC(=C1)Cl)Cl)C(CCN2CCC(CC2)N3CCCN(C)C3=O)C4=CC=C(Cl)C(=C4)Clg}qtK|Owvϟ*봷/ x^<ӻs9e׸cJ9{ޒ?.8/KjGc϶;H63 4.59807634 2.619999890?H64 3.98749542 1.107661840@H654.386024 0.4173905850AH66 5.06557369 0.02505244310BH67 5.86262989 0.02505244310CH68 2.46749711 1.525052430DH69 3.26455379 1.525052430EH70 1.3894192 2.607661960FH71 1.78794765 1.917390580GH72 1.78794765 4.082609650HH73 1.3894192 3.392338040IH74 3.4860253350JH75 2.86602545 5.619999890KH76 2.2460255650LH77 9.46513939 -2.189999820MH78 9.46513939 -3.810000180NH79 6.6592164 -2.19000006082                ! " !#"$"#%#$&$%'%&(%')'(*"(+'),*-+.,/-0.1/20314 25 364758697:8;9<:=;><?=@>A?B@CADBECFDGEHFIGJHKILJMKN#LO$MP(NQH00000000-0000-0000-0000-000000000000vKݩ6#ǜLb{` 50110650*jL)>VzAmide oxime?8aCnCJF@"?33@%Kt7& CN(CC(=NOCCN1CCNCC1)C(CCN2CCC(CC2)N3CCCCC3=O)C4=CC=C(Cl)C(=C4)Cl)C(=O)C5=CC(=CC(=C5)Cl)Clg}qv[\_wv+}㼷 {~=׻~}e׸cJ?{ݟD^6?.8P/[.Ͼ;>o'=qOSA$a359a293-8122-4324-8c44-4b0c43ce21b694C1 10.66025350.50N2 9.7942285510C3 8.928203580.50C4 8.92820358-0.50N5 9.79422855-10O6 10.6602535-0.50C7 11.5262794-10C8 12.3923044-0.50N9 13.2583303-10 C10 13.2583303-20 C11 14.1243553-2.50 N12 14.9903812-20 C13 14.9903812-10 C14 14.1243553-0.50C15 8.06217766-10C16 7.19615221-0.50C17 7.196152210.50N18 6.3301272410C19 6.3301272420C20 5.464101792.50C21 4.5980763420C22 4.5980763410C23 5.464101790.50N24 3.73205092.50C25 2.8660254520C2622.50C2723.50C28 2.8660254540C29 3.73205093.50O30 4.5980763440C31 8.06217766-20C32 8.92820358-2.50 C33 8.92820358-3.50!C34 8.06217766-40"Cl35 8.06217766-50#C36 7.19615221-3.50$C37 7.19615221-2.50%Cl38 6.33012724-40&C39 9.7942285520'O40 8.928203582.50(C41 10.66025352.50)C42 11.526279420*C43 12.39230442.50+C44 12.39230443.50,C45 11.526279440-C46 10.66025353.50.Cl47 11.526279450/Cl48 13.2583303200H49 10.350255 -0.036935832401H50 11.1971903 0.19000014702H51 10.9702539 1.0369358103H52 8.71615124 1.0826094204H53 8.31762314 0.39233809705H54 11.1277514 -1.4749475706H55 11.9248075 -1.4749475707H56 12.7908325 -0.025052348208H57 11.9937763 -0.025052538109H58 12.6477499 -1.892338040:H59 13.046278 -2.582609420;H60 13.7258272 -2.974947690<H61 14.5228834 -2.974947690=H62 15.527317 -2.309999940>H63 15.6009617 -1.107661840?H64 15.2024336 -0.4173905250@H65 14.5228834 -0.02505234820AH66 13.7258272 -0.02505253810BH67 8.06217766 -0.3799999950CH68 6.58557129 -0.3923381270DH69 6.98409986 -1.082609420EH70 7.80673313 0.3923380970FH71 7.40820456 1.082609420GH72 6.94070816 1.892338160HH73 6.54217958 2.582609420IH74 5.86262989 2.974947690JH75 5.06557369 2.974947690KH76 4.59807634 2.619999890LH77 3.98749542 1.107661840MH784.386024 0.4173905850NH79 5.06557369 0.02505244310OH80 5.86262989 0.02505244310PH81 2.46749711 1.525052430QH82 3.26455379 1.525052430RH83 1.3894192 2.607661960SH84 1.78794765 1.917390580TH85 1.78794765 4.082609650UH86 1.3894192 3.392338040VH87 3.26455379 4.474947450WH88 2.46749711 4.474947450XH89 9.46513939 -2.189999820YH90 9.46513939 -3.810000180ZH91 6.6592164 -2.190000060[H92 11.52627941.380\H93 12.9292402 3.809999940]H94 10.1233187 3.80999994098            ! " !#!"$!#%#$&$'#%(&)&'*&(+(),)*-*+.+,/,-0(-1,.2*/30415263748596:7;8< 9= :> ;? <@ =A >B ?C @D AEBFCGDHEIFJGKHLIMJNKOLPMQNROSPTQURVSWTXUYVZW[X\ Y]$Z^)[_+\`-]aH00000000-0000-0000-0000-0000000000007dO;uJ#ǜLb{` 50116727*jL)>VzAmide oxime?8aCnCJF@"?33@%Kt7& CON=C(CN(C)C(=O)C1=CC(=CC(=C1)Cl)Cl)C(CCN2CCC(CC2)N3CCCN(CC(C)(C)O)C3=O)C4=CC=C(Cl)C(=C4)Clg}qtK|Owvϟ*봿/ x_3}o/7OSA$35f8dea0-e70e-4e32-9922-d8efd53e5ffa89C1 3.7320509 -1.904999970O2 4.59807634 -2.404999970N3 5.46410179 -1.904999970C4 6.33012724 -2.404999970C5 6.33012724 -3.404999970N6 5.46410179 -3.904999970C7 4.59807634 -3.404999970C8 5.46410179 -4.905000210O9 6.33012724 -5.405000210 C10 4.59807634 -5.405000210 C11 3.7320509 -4.905000210 C12 2.86602545 -5.405000210 C13 2.86602545 -6.405000210 C14 3.7320509 -6.905000210C15 4.59807634 -6.405000210Cl16 3.7320509 -7.905000210Cl172 -4.905000210C18 7.19615221 -1.904999970C19 7.19615221 -0.9049999710C20 6.33012724 -0.4050000010N21 6.33012724 0.5950000290C22 7.19615221 1.095000030C23 7.19615221 2.095000030C24 6.33012724 2.595000030C25 5.46410179 2.095000030C26 5.46410179 1.095000030N27 6.33012724 3.595000030C28 7.19615221 4.094999790C29 7.19615221 5.094999790C30 6.33012724 5.594999790N31 5.46410179 5.094999790C32 4.59807634 5.594999790 C33 4.59807634 6.594999790!C34 5.59807634 6.594999790"C35 3.59807611 6.594999790#O36 4.59807634 7.594999790$C37 5.46410179 4.094999790%O38 4.59807634 3.595000030&C39 8.06217766 -2.404999970'C40 8.92820358 -1.904999970(C41 9.79422855 -2.404999970)C42 9.79422855 -3.404999970*Cl43 10.6602535 -3.904999970+C44 8.92820358 -3.904999970,C45 8.06217766 -3.404999970-Cl46 8.92820358 -4.905000210.H47 4.04205084 -1.368064170/H48 3.19511509 -1.5950000300H49 3.42205095 -2.4419357801H50 6.54217958 -3.9876093902H51 6.94070816 -3.2973380103H52 4.90807629 -2.8680641704H53 4.06114054 -3.0950000305H54 4.2880764 -3.9419357806H55 3.7320509 -4.2850003207H56 2.32908964 -6.7150001508H57 5.13501215 -6.7150001509H58 6.6592164 -1.595000030:H59 7.80673313 -1.012661930;H60 7.40820456 -0.3223905860<H61 5.71954632 -0.2973380980=H62 6.11807489 -0.9876093860>H63 7.40820456 0.5123906140?H64 7.80673313 1.202661990@H65 7.80673313 1.987338070AH66 7.40820456 2.677609440BH67 6.86706305 2.904999970CH68 5.25204945 2.677609440DH69 4.85352087 1.987338190EH70 4.85352087 1.202661870FH71 5.25204945 0.5123906140GH72 7.40820456 3.512390380HH73 7.80673313 4.202661510IH74 7.80673313 4.987338070JH75 7.40820456 5.677608970KH76 6.72865582 6.069947240LH77 5.93159914 6.069947240MH78 3.98749542 5.702661510NH794.386024 5.012390140OH80 5.59807634 5.97499990PH81 6.21807623 6.594999790QH82 5.59807634 7.214999680RH83 3.59807611 7.214999680SH84 2.97807622 6.594999790TH85 3.59807611 5.97499990UH86 4.06114054 7.905000210VH87 8.92820358 -1.284999970WH88 10.3311644 -2.095000030XH89 7.52524185 -3.71500015092                ! !" 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"!#!"$"#%#$&$%'$&(&')!'*#(+),*-+.,/-0.1/203 14 25364758697:8;9<:=;><?=@>A?B@CADBECFDGEHFIGJHKILJMKN LO"MP&NQ'ORH00000000-0000-0000-0000-000000000000vD.&KJğ~$#ǜLb{` 50116081*jL)>VzAmide oxime?8aCnCJF@"?33@%Kt7& CON=C(CN(C)C(=O)C1=CC(=CC(=C1)Cl)Cl)C(CCN2CCC(CC2)N3CCCC(CC(=O)[S+]4CCNCC4)C3=O)C5=CC=C(Cl)C(=C5)Cloqw\7+ߏ3~<s=gck?{g_v/xS/k*Gc߷;H63 8.34366894 -1.357661840?H64 7.94514036 -0.6673905850@H65 6.25648165 -0.6423381570AH66 6.65501022 -1.332609420BH67 7.94514036 0.167390570CH68 8.34366894 0.8576618430DH69 8.34366894 1.642338160EH70 7.94514036 2.332609420FH71 6.33012676 2.559999940GH72 5.78898525 2.332609420HH73 5.39045668 1.642338040IH74 5.39045668 0.8576619030JH75 5.78898525 0.16739060KH76 7.94514036 3.167390580LH77 8.34366894 3.857661960MH78 8.34366894 4.642338280NH79 7.94514036 5.332609650OH80 7.26559067 5.724947450PH81 6.46853399 5.724947450QH82 5.46410179 4.440000060RH83 4.52443123 5.357661720SH84 4.9229598 4.667390350TH85 4.87956762 7.642338280UH86 4.48103905 8.332609180VH87 3.80148959 8.724947930WH88 3.00443292 8.724947930XH892 8.060000420YH901.926355 6.857661720ZH91 2.32488322 6.167390350[H92 3.00443292 5.775052550\H93 3.80148959 5.775052550]H94 9.46513939-1.630^H95 10.8681002 -2.440000060_H96 8.06217766 -4.059999940100                ! !" 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6.33012724 3.559999940C8 5.46410179 4.059999940C9 5.46410179 5.059999940 C10 4.59807634 5.559999940 C11 3.7320509 5.059999940 C12 3.7320509 4.059999940 C13 4.59807634 3.559999940 C14 2.86602545 3.559999940 F15 2.36602545 4.426025390 F162 3.059999940 F17 3.36602545 2.693974490C18 4.59807634 6.559999940 F19 3.59807611 6.559999940 F20 4.59807634 7.559999940 F21 5.59807634 6.559999940C22 9.79422855 3.559999940C23 9.79422855 2.559999940C24 10.6602535 2.059999940N25 10.6602535 1.059999940C26 9.79422855 0.5600000020C27 9.79422855 -0.4399999980C28 10.6602535 -0.9399999980C29 11.5262794 -0.4399999980C30 11.5262794 0.5600000020C31 10.6602535 -1.940000060N32 11.5262794 -2.440000060 C33 12.3923044 -1.940000060!C34 13.2583303 -2.440000060"C35 13.2583303 -3.440000060#C36 12.3923044 -3.940000060$C37 12.3923044 -4.940000060%C38 13.2583303 -5.440000060&O39 14.1243553 -4.940000060'C40 13.2583303 -6.440000060(O41 14.1243553 -6.940000060)C42 11.5262794 -3.440000060*O43 10.6602535 -3.940000060+C44 10.6602535 4.059999940,C45 10.6602535 5.059999940-C46 11.5262794 5.559999940.C47 12.3923044 5.059999940/Cl48 13.2583303 5.5599999400C49 12.3923044 4.0599999401C50 11.5262794 3.5599999402Cl51 13.2583303 3.5599999403H52 8.68217754 6.5599999404H53 8.06217766 7.1799998305H54 7.44217777 6.5599999406H55 7.66364908 3.0850524907H56 8.46070576 3.0850522508H57 5.93159914 3.0850522509H58 6.72865582 3.085052490:H59 6.0010376 5.369999890;H60 3.19511509 5.369999890<H61 4.59807634 2.940000060=H62 9.257292753.250>H63 9.18364811 2.667661670?H64 9.58217621 1.977390530@H65 11.2708349 1.95233810AH66 10.8723068 2.642609360BH67 9.58217621 1.142609480CH68 9.18364811 0.4523381890DH69 9.18364811 -0.3323381840EH70 9.58217621 -1.022609470FH71 11.1971903 -1.249999880GH72 11.7383318 -1.022609350HH73 12.1368599 -0.3323380950IH74 12.1368599 0.4523380990JH75 11.7383318 1.142609360KH76 10.049674 -1.832338090LH77 10.4482021 -2.522609470MH78 12.7908325 -1.465052370NH79 11.9937763 -1.46505260OH80 13.8689108 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C11 6.330127243.50 O12 5.4641017940 N13 6.330127242.50 C14 7.1961522120C15 7.1961522110N16 6.330127240.50C17 5.4641017910C18 5.4641017920C19 4.598076340.50C20 3.732050910C21 2.866025450.50C22 2.86602545-0.50Cl232-10C24 3.7320509-10C25 4.59807634-0.50Cl26210C27 6.33012724-0.50O28 5.46410179-10C29 7.19615221-10N30 7.19615221-20C31 8.06217766-2.50C32 8.06217766-3.50 C33 8.92820358-40!N34 9.79422855-3.50"C35 9.79422855-2.50#C36 8.92820358-20$C37 10.6602535-40%C38 10.6602535-50&C39 9.79422855-5.50'C40 9.79422855-6.50(C41 10.6602535-70)C42 11.5262794-6.50*C43 11.5262794-5.50+H44 9.23820305 6.463064190,H45 9.46513939 7.309999940-H46 8.61820412 7.536935810.H47 6.6592164 5.309999940/H48 8.06217766 2.8800001100H49 9.46513939 5.3099999401H50 10.9702539 3.4630641902H51 11.1971903 4.3099999403H52 10.350255 4.5369358104H53 7.80673313 1.8923380405H54 7.40820456 2.5826094206H55 7.40820456 0.41739061507H56 7.80673313 1.1076619608H57 5.46410179 0.37999999509H58 5.25204945 2.582609420:H59 4.85352087 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" !#!"$"#%#&!$'$%(%&)&'*'(+(),)*-%*.+/,0-1.2/304 15 26 37 48 596:7;8<9=:>;?<@=A>B?C@DAEBFCG DH EI"FJ"GK#HL#IM$JN$KO&LP'MQ(NR)OS*PT0H00000000-0000-0000-0000-0000000000009wG7S`#ǜLb{` 50110647*jL)>VzAmide oxime?8aCnCJF@ C`?33@%Kt7& CSCCCON=C(CN(C)C(=O)C1=CC(=CC(=C1)Cl)Cl)C(CCN2CCC(CC2)N3CCCCC3=O)C4=CC=C(Cl)C(=C4)Cloqv[\_7j)z<׻~s9mcJ9?{6?.8Pߖk*Gc϶;Vz"Phenyl piperazine?8aCnCJF@ :^@?33@%Kt7& ClC1=CC(=CC(=C1)Cl)C(=O)N2CCN(C(C2)C3=CC(=C(Cl)C=C3)Cl)C(=O)CNC4CCN(CC4)CC5=CC=CC=C5û}}vc] yk]ư;O}ҙvyye?#;q[ծ ~_.^;OtĦ*lǗ4ߞ+v귓~ip%lkOSA$8c91164b-b88b-497b-a194-77e83608560573Cl1 8.062177666.750C2 8.062177665.750C3 7.196152215.250C4 7.196152214.250C5 8.062177663.750C6 8.928203584.250C7 8.928203585.250Cl8 9.794228553.750C9 6.330127243.750 O10 5.464101794.250 N11 6.330127242.750 C12 7.196152212.250 C13 7.196152211.250 N14 6.330127240.750C15 5.464101791.250C16 5.464101792.250C17 4.598076340.750C18 3.73205091.250C19 2.866025450.750C20 2.86602545-0.250Cl212-0.750C22 3.7320509-0.750C23 4.59807634-0.250Cl2421.250C25 6.33012724-0.250O26 5.46410179-0.750C27 7.19615221-0.750N28 7.19615221-1.750C29 8.06217766-2.250C30 8.06217766-3.250C31 8.92820358-3.750N32 9.79422855-3.250 C33 9.79422855-2.250!C34 8.92820358-1.750"C35 10.6602535-3.750#C36 10.6602535-4.750$C37 9.79422855-5.250%C38 9.79422855-6.250&C39 10.6602535-6.750'C40 11.5262794-6.250(C41 11.5262794-5.250)H42 6.6592164 5.559999940*H43 8.06217766 3.130000110+H44 9.46513939 5.559999940,H45 7.80673313 2.142338040-H46 7.40820456 2.832609420.H47 7.40820456 0.6673905850/H48 7.80673313 1.3576619600H49 5.46410179 0.62999999501H50 5.25204945 2.8326094202H51 4.85352087 2.1423380403H52 3.73205091.8704H53 3.7320509-1.3705H54 5.13501215 -0.56000000206H55 7.80673313 -0.85766190307H56 7.40820456 -0.167390608H57 6.65921688 -2.0599999409H58 8.06217766-1.630:H59 7.45159674 -3.142338280;H60 7.85012531 -3.832609420<H61 8.52967548 -4.224947450=H62 9.32673168 -4.224947450>H63 10.404809 -2.357661960?H64 10.0062809 -1.667390580@H65 9.32673168 -1.275052550AH66 8.52967548 -1.275052310BH67 11.2708349 -3.857661720CH68 10.8723068 -3.167390580DH69 9.25729275 -4.940000060EH70 9.25729275 -6.559999940FH71 10.6602535 -7.369999890GH72 12.0632153 -6.559999940HH73 12.0632153 -4.94000006077             ! " !#!$"%"#&#$'$%(%&)&'*'(+#(,)-*.+/ ,0 -1 .2 /30415263748596:7;8<9=:>;?<@=A >B ?C!@D!AE"BF"CG$DH%EI&FJ'GK(HL0H00000000-0000-0000-0000-0000000000002H(;WP##ǜLb{` 50096935*jL)>Vz*Monobasic ether oxime?8aCnCJF@ 1?33@%Kt7& CON=C(COCC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(CCN2CCC(CC2)C(N)=O)C3=CC=C(Cl)C(=C3)Cl&WeUy|VLߩ\OgwwNjrVF&ss"y]SJs>-]xO}xS]o%Gƕ<37U7]OSA$0e68f6f6-2cee-4ca3-ab01-12c78bd9f4a170C1 8.06217766 4.309999940O2 8.06217766 3.309999940N3 8.92820358 2.809999940C4 8.92820358 1.809999940C5 8.06217766 1.309999940O6 7.19615221 1.809999940C7 6.33012724 1.309999940C8 5.46410179 1.809999940C9 5.46410179 2.809999940 C10 4.59807634 3.309999940 C11 3.7320509 2.809999940 C12 3.7320509 1.809999940 C13 4.59807634 1.309999940 C14 2.86602545 1.309999940 F15 2.36602545 2.176025390 F162 0.8100000020 F17 3.36602545 0.4439745840C18 4.59807634 4.309999940 F19 3.59807611 4.309999940 F20 4.59807634 5.309999940 F21 5.59807634 4.309999940C22 9.79422855 1.309999940C23 9.79422855 0.3100000020C24 10.6602535 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CON=C(COCC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(CCN2CCC(CC2)N3CCCC3C(N)=O)C4=CC=C(Cl)C(=C4)Cl'Wg}y|VLݹ!\OgOJr^F$ssy]SJ{?-]xO}xS]o%Ǖ<7U7OSA$d99c513a-fa67-4e08-9317-9a164182999482C1 8.06217766 4.527175430O2 8.06217766 3.527175190N3 8.92820358 3.027175190C4 8.92820358 2.027175190C5 8.06217766 1.527175190O6 7.19615221 2.027175190C7 6.33012724 1.527175190C8 5.46410179 2.027175190C9 5.46410179 3.027175190 C10 4.59807634 3.527175190 C11 3.7320509 3.027175190 C12 3.7320509 2.027175190 C13 4.59807634 1.527175190 C14 2.86602545 1.527175190 F15 2.36602545 2.393200640 F162 1.027175190 F17 3.36602545 0.66114980C18 4.59807634 4.527175430 F19 3.59807611 4.527175430 F20 4.59807634 5.527175430 F21 5.59807634 4.527175430C22 9.79422855 1.527175190C23 9.79422855 0.5271751880C24 10.6602535 0.02717518810N25 10.6602535 -0.9728248120C26 9.79422855 -1.472824810C27 9.79422855 -2.472824810C28 10.6602535 -2.972824810C29 11.5262794 -2.472824810C30 11.5262794 -1.472824810N31 10.6602535 -3.972824810C32 11.4692707 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10.738204 7.085973740QH82 9.11820316 7.085973740RH83 8.3082037 5.683012490SH84 5.13501215 2.760961770TH85 2.329089641.1409620UH86 3.7320509 0.330961883089              ! !"!"#"#$#$%$&%'%&(&')'(*()+(*,*+-%+.',/-0.1/20314253647 58697:8;9<:=;><?=@>A?B@CADBECFDGEHFIGJHKILJMKNLOMP NQ!OR"PS#QT$RU&SV*TW+UX0H00000000-0000-0000-0000-000000000000ƛPQG@ػ#ǜLb{` 50096931*jL)>Vz*Monobasic ether oxime?8aCnCJF@C?33@%Kt7& CON=C(COCC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(CCN2CCC(CC2)CN3CCCCC3CCO)C4=CC=C(Cl)C(=C4)Cl'WeUy|ULߩ]OgwjrWfdsS"y]SJs>-_xO}xS_oG֕<3k7U7OSA$c939f144-667b-487b-a28b-f961cc53bb9b91C1 8.06217766 5.809999940O2 8.06217766 4.809999940N3 8.92820358 4.309999940C4 8.92820358 3.309999940C5 8.06217766 2.809999940O6 7.19615221 3.309999940C7 6.33012724 2.809999940C8 5.46410179 3.309999940C9 5.46410179 4.309999940 C10 4.59807634 4.809999940 C11 3.7320509 4.309999940 C12 3.7320509 3.309999940 C13 4.59807634 2.809999940 C14 2.86602545 2.809999940 F15 2.36602545 3.676025390 F162 2.309999940 F17 3.36602545 1.943974610C18 4.59807634 5.809999940 F19 3.59807611 5.809999940 F20 4.59807634 6.809999940 F21 5.59807634 5.809999940C22 9.79422855 2.809999940C23 9.79422855 1.809999940C24 10.6602535 1.309999940N25 10.6602535 0.3100000020C26 9.79422855 -0.1899999980C27 9.79422855 -1.190000060C28 10.6602535 -1.690000060C29 11.5262794 -1.190000060C30 11.5262794 -0.1899999980C31 10.6602535 -2.690000060N32 11.5262794 -3.190000060 C33 12.3923044 -2.690000060!C34 13.2583303 -3.190000060"C35 13.2583303 -4.190000060#C36 12.3923044 -4.690000060$C37 11.5262794 -4.190000060%C38 10.6602535 -4.690000060&C39 10.6602535 -5.690000060'O40 9.79422855 -6.190000060(C41 10.6602535 3.309999940)C42 10.6602535 4.309999940*C43 11.5262794 4.809999940+C44 12.3923044 4.309999940,Cl45 13.2583303 4.809999940-C46 12.3923044 3.309999940.C47 11.5262794 2.809999940/Cl48 13.2583303 2.8099999400H49 8.68217754 5.8099999401H50 8.06217766 6.4299998302H51 7.44217777 5.8099999403H52 7.66364908 2.3350524904H53 8.46070576 2.3350522505H54 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140 0 0 1 0 1 0 68 33 66 11 141 0 0 1 0 1 0 69 34 67 11 142 0 0 1 0 1 0 70 35 68 11 143 0 0 1 0 1 0 71 36 69 11 144 0 0 1 0 1 0 72 37 70 11 145 0 0 1 0 1 0 73 3fb4dac1-66a1-4e13-81b8-2af672074a61 0 1 0 0 0 1H00000000-0000-0000-0000-000000000000KhOwWCCS0\l#ǜLb{` 50093105*jL)>Vz&Dibasic ether oxime?8aCnCJF@/?33@%Kt7& CON=C(COCC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(CCN2CCN(CC2)CC(=O)N3CCC(O)C3)C4=CC(=C(Cl)C=C4)Cl&WeUy}uݹ\gww_JzVF[t[sy]SHsVz*Monobasic ether oxime?8aCnCJF@/?33@%Kt7& CCOC(=O)C1CCCN(CC2CCN(CC2)CCC(C(COCC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)=NOC)C4=CC=C(Cl)C(=C4)Cl)C1'WeUy|WLߩݩOgwjrVNfss"y]SJs>-ݹO}xS]oWǵ<;k7U7<OSA$27f81ced-5f41-40ab-a51f-1954879cf3da93C1 16.7224312-4.250C2 15.8564062-3.750O3 14.9903812-4.250C4 14.1243553-3.750O5 14.1243553-2.750C6 13.2583303-4.250C7 13.2583303-5.250C8 12.3923044-5.750C9 11.5262794-5.250 N10 11.5262794-4.250 C11 10.6602535-3.750 C12 10.6602535-2.750 C13 11.5262794-2.250 C14 11.5262794-1.250N15 10.6602535-0.750C16 9.79422855-1.250C17 9.79422855-2.250C18 10.66025350.250C19 9.794228550.750C20 9.794228551.750C21 8.928203582.250C22 8.062177661.750O23 7.196152212.250C24 6.330127241.750C25 5.464101792.250C26 5.464101793.250C27 4.598076343.750C28 3.73205093.250C29 3.73205092.250C30 4.598076341.750C31 2.866025451.750 F32 2.36602545 2.616025450 F3321.250 !F34 3.36602545 0.8839746120"C35 4.598076344.750 #F36 3.598076114.750 $F37 4.598076345.750 %F38 5.598076344.750&N39 8.928203583.250'O40 8.062177663.750(C41 8.062177664.750)C42 10.66025352.250*C43 10.66025353.250+C44 11.52627943.750,C45 12.39230443.250-Cl46 13.25833033.750.C47 12.39230442.250/C48 11.52627941.7500Cl49 13.25833031.7501C50 12.3923044-3.7502H51 16.4124317 -4.7869358103H52 17.2593689 -4.5599999404H53 17.0324306 -3.7130644305H54 16.2549343 -3.2750525506H55 15.4578781 -3.2750525507H56 13.7952662 -4.5599999408H57 13.4703827 -5.8326096509H58 13.8689108 -5.142338280:H59 11.9937763 -6.224947450;H60 12.7908325 -6.224947450<H61 10.915699 -5.142338280=H62 11.3142271 -5.832609180>H63 10.049674 -3.642338040?H64 10.4482021 -4.332609180@H65 11.1971903 -3.059999940AH66 11.7383318 -2.832609420BH67 12.1368599 -2.142338040CH68 12.1368599 -1.357661960DH69 11.7383318 -0.6673905850EH70 9.58217621 -0.6673905250FH71 9.18364811 -1.357661840GH72 9.18364811 -2.142338280HH73 9.58217621 -2.832609420IH74 11.2708349 0.1423381870JH75 10.8723068 0.8326094750KH76 9.18364811 0.8576618430LH77 9.58217621 0.167390540MH78 9.25729275 1.440000060NH79 7.66364908 1.275052430OH80 8.46070576 1.275052430PH81 5.93159914 1.275052430QH82 6.72865582 1.275052550RH83 6.0010376 3.559999940SH84 3.19511509 3.559999940TH85 4.598076341.130UH86 8.682177544.750VH87 8.06217766 5.369999890WH88 7.442177774.750XH89 10.1233187 3.559999940YH90 11.5262794 4.369999890ZH91 11.52627941.130[H92 12.7908325 -3.275052310\H93 11.9937763 -3.27505255096            !!""#"#$"$%"%&&'&'('())*)*+*+,+,-,-.,././0)/1.02 131425364758697:8;9<:=;><?=@ >A ?B @C AD BE CF DGEHFIGJHKILJMKNLOMPNQORPSQTRUSVTW(UX(VY(WZ*X[+Y\/Z]1[^1\_0H00000000-0000-0000-0000-000000000000' ANhX)#ǜLb{` 50096949*jL)>Vz*Monobasic ether oxime?8aCnCJF@/?33@%Kt7& CON=C(COCC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(CCN2CCC(CC2)N3CCCC3=S)C4=CC=C(Cl)C(=C4)Cl&wg]y}|Lݩ\OgwwOZrVesS"y]SZ{>-]xO}xS]o%G畹<7k7U7OSA$3dccb0dd-5e5a-4b5f-b2a3-99c9a003062677C1 8.06217766 4.51942110O2 8.06217766 3.519420860N3 8.92820358 3.019420860C4 8.92820358 2.019420860C5 8.06217766 1.519420860O6 7.19615221 2.019420860C7 6.33012724 1.519420860C8 5.46410179 2.019420860C9 5.46410179 3.019420860 C10 4.59807634 3.519420860 C11 3.7320509 3.019420860 C12 3.7320509 2.019420860 C13 4.59807634 1.519420860 C14 2.86602545 1.519420860 F15 2.36602545 2.385446310 F162 1.019420860 F17 3.36602545 0.6533954740C18 4.59807634 4.51942110 F19 3.59807611 4.51942110 F20 4.59807634 5.51942110 F21 5.59807634 4.51942110C22 9.79422855 1.519420860C23 9.79422855 0.5194208620C24 10.6602535 0.01942088450N25 10.6602535 -0.9805791380C26 9.79422855 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9.58217621 -3.063188550?H64 11.1971903 -3.290579080@H65 11.7383318 -3.063188550AH66 12.1368599 -2.372917180BH67 12.1368599 -1.58824110CH68 11.7383318 -0.8979697230DH69 12.0356693 -4.820540430EH70 11.7792702 -4.031428340FH71 11.0954466 -6.136024480GH72 11.7667065 -5.648325920HH73 9.55380344 -5.64832640IH74 10.2250624 -6.136024480JH75 10.1233187 3.32942080KH76 11.5262794 4.139420990LH77 11.5262794 0.899420857080                ! !"!"#"$"#%$&$%'%&(&')'(*')+)*,$*-)+.,/-0.1/203142536 47 58697:8;9<:=;><?=@>A?B@CADBECFDGEH FI GJ!HK!IL%JM&KN*LO0H00000000-0000-0000-0000-000000000000{Avd%m #ǜLb{` 50096954*jL)>Vz*Monobasic ether oxime?8aCnCJF@z?33@%Kt7& CON=C(COCC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(CCN2CCC(CC2)CN3CCCC(C3)OC(=O)NC(C)C)C4=CC=C(Cl)C(=C4)Cl/WUy}Tߩ]Oww^krwG[&_}}[Js?m]xo}x]Gޗ<77AOSA$ba6d1b33-97e6-4561-bdcd-69d05551c1c598C1 8.062177666.750O2 8.062177665.750N3 8.928203585.250C4 8.928203584.250C5 8.062177663.750O6 7.196152214.250C7 6.330127243.750C8 5.464101794.250C9 5.464101795.250 C10 4.598076345.750 C11 3.73205095.250 C12 3.73205094.250 C13 4.598076343.750 C14 2.866025453.750 F15 2.36602545 4.616025450 F1623.250 F17 3.36602545 2.883974550C18 4.598076346.750 F19 3.598076116.750 F20 4.598076347.750 F21 5.598076346.750C22 9.794228553.750C23 9.794228552.750C24 10.66025352.250N25 10.66025351.250C26 9.794228550.750C27 9.79422855-0.250C28 10.6602535-0.750C29 11.5262794-0.250C30 11.52627940.750C31 10.6602535-1.750N32 11.5262794-2.250 C33 12.3923044-1.750!C34 13.2583303-2.250"C35 13.2583303-3.250#C36 12.3923044-3.750$C37 11.5262794-3.250%O38 12.3923044-4.750&C39 13.2583303-5.250'O40 14.1243553-4.750(N41 13.2583303-6.250)C42 14.1243553-6.750*C43 14.9903812-6.250+C44 14.1243553-7.750,C45 10.66025354.250-C46 10.66025355.250.C47 11.52627945.750/C48 12.39230445.2500Cl49 13.25833035.7501C50 12.39230444.2502C51 11.52627943.7503Cl52 13.25833033.7504H53 8.682177546.7505H54 8.06217766 7.3699998906H55 7.442177776.7507H56 7.66364908 3.2750525508H57 8.46070576 3.2750523109H58 5.93159914 3.275052310:H59 6.72865582 3.275052550;H60 6.0010376 5.559999940<H61 3.19511509 5.559999940=H62 4.59807634 3.130000110>H63 9.25729275 3.440000060?H64 9.18364811 2.857661720@H65 9.58217621 2.167390580AH66 11.2708349 2.142338280BH67 10.8723068 2.832609420CH68 9.58217621 1.332609420DH69 9.18364811 0.6423381570EH70 9.18364811 -0.1423381870FH71 9.58217621 -0.8326094750GH72 11.1971903 -1.059999940HH73 11.7383318 -0.8326094150IH74 12.1368599 -0.1423380820JH75 12.1368599 0.6423380970KH76 11.7383318 1.332609420LH77 10.049674 -1.642338040MH78 10.4482021 -2.332609420NH79 12.7908325 -1.275052310OH80 11.9937763 -1.275052550PH81 13.8689108 -2.357661720QH82 13.4703827 -1.667390580RH83 13.4703827 -3.832609420SH84 13.8689108 -3.142338280TH85 11.8553686 -4.059999940UH86 10.915699 -3.142338040VH87 11.3142271 -3.832609420WH88 12.7213945 -6.559999940XH89 13.5874205 -7.059999940YH90 15.3003807 -6.786935810ZH91 15.527317 -5.940000060[H92 14.6803818 -5.713064190\H93 13.5043554-7.750]H94 14.1243553 -8.369999890^H95 14.7443552-7.750_H96 10.1233187 5.559999940`H97 11.5262794 6.369999890aH98 11.5262794 3.130000110101                ! !"!"#"#$#$%$&#%'%&(&')&(*()+)*,)+-,.,-/-.0./1/02/13124,251364758697:8;9<:=;> <? =@>A?B@CADBECFDGEHFIGJHKILJMKNLOMP NQ OR!PS!QT"RU"SV#TW$UX$VY(WZ)X[*Y\*Z]*[^+\_+]`+^a-_b.`c2ad0H00000000-0000-0000-0000-000000000000jiS]tF6_#ǜLb{` 50096943*jL)>Vz*Monobasic ether oxime?8aCnCJF@@?33@%Kt7& CON=C(COCC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(CCN2CCC(CC2)N3CCCCC3=O)C4=CC=C(Cl)C(=C4)ClWg]y|vLݩ\OgwOJrVF$ss#y]SJ{>-]xO}|W]o%Gϕ<;7U7@22 serialization::archive 9 2 1 2 0 0 0 80 83 0 0 0 0 0 1 5 1 5 1 0 1 0 0 0 0 6 2 C1 0 0 0 8.0621777 4.75 0 0 5 2 0 0 8 2 O2 0 8.0621777 3.75 0 1 5 3 0 0 7 2 N3 0 8.9282036 3.25 0 2 5 4 0 0 6 2 C4 0 8.9282036 2.25 0 3 5 5 0 0 6 2 C5 0 8.0621777 1.75 0 4 5 6 0 0 8 2 O6 0 7.1961522 2.25 0 5 5 7 0 0 6 2 C7 0 6.3301272 1.75 0 6 5 8 0 0 6 2 C8 0 5.4641018 2.25 0 7 5 9 0 0 6 2 C9 0 5.4641018 3.25 0 8 5 10 0 0 6 3 C10 0 4.5980763 3.75 0 9 5 11 0 0 6 3 C11 0 3.7320509 3.25 0 10 5 12 0 0 6 3 C12 0 3.7320509 2.25 0 11 5 13 0 0 6 3 C13 0 4.5980763 1.75 0 12 5 14 0 0 6 3 C14 0 2.8660254 1.75 0 13 5 15 0 0 9 3 F15 0 2.3660254 2.6160254 0 14 5 16 0 0 9 3 F16 0 2 1.25 0 15 5 17 0 0 9 3 F17 0 3.3660254 0.88397461 0 16 5 18 0 0 6 3 C18 0 4.5980763 4.75 0 17 5 19 0 0 9 3 F19 0 3.5980761 4.75 0 18 5 20 0 0 9 3 F20 0 4.5980763 5.75 0 19 5 21 0 0 9 3 F21 0 5.5980763 4.75 0 20 5 22 0 0 6 3 C22 0 9.7942286 1.75 0 21 5 23 0 0 6 3 C23 0 9.7942286 0.75 0 22 5 24 0 0 6 3 C24 0 10.660254 0.25 0 23 5 25 0 0 7 3 N25 0 10.660254 -0.75 0 24 5 26 0 0 6 3 C26 0 9.7942286 -1.25 0 25 5 27 0 0 6 3 C27 0 9.7942286 -2.25 0 26 5 28 0 0 6 3 C28 0 10.660254 -2.75 0 27 5 29 0 0 6 3 C29 0 11.526279 -2.25 0 28 5 30 0 0 6 3 C30 0 11.526279 -1.25 0 29 5 31 0 0 7 3 N31 0 10.660254 -3.75 0 30 5 32 0 0 6 3 C32 0 11.526279 -4.25 0 31 5 33 0 0 6 3 C33 0 11.526279 -5.25 0 32 5 34 0 0 6 3 C34 0 10.660254 -5.75 0 33 5 35 0 0 6 3 C35 0 9.7942286 -5.25 0 34 5 36 0 0 6 3 C36 0 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10.872307 0.83260947 0 59 5 61 0 0 1 3 H61 0 9.5821762 -0.66739053 0 60 5 62 0 0 1 3 H62 0 9.1836481 -1.3576618 0 61 5 63 0 0 1 3 H63 0 9.1836481 -2.1423383 0 62 5 64 0 0 1 3 H64 0 9.5821762 -2.8326094 0 63 5 65 0 0 1 3 H65 0 11.19719 -3.0599999 0 64 5 66 0 0 1 3 H66 0 11.738332 -2.8326094 0 65 5 67 0 0 1 3 H67 0 12.13686 -2.142338 0 66 5 68 0 0 1 3 H68 0 12.13686 -1.357662 0 67 5 69 0 0 1 3 H69 0 11.738332 -0.66739058 0 68 5 70 0 0 1 3 H70 0 12.13686 -4.3576617 0 69 5 71 0 0 1 3 H71 0 11.738332 -3.6673906 0 70 5 72 0 0 1 3 H72 0 11.738332 -5.8326092 0 71 5 73 0 0 1 3 H73 0 12.13686 -5.1423383 0 72 5 74 0 0 1 3 H74 0 10.261726 -6.2249475 0 73 5 75 0 0 1 3 H75 0 11.058783 -6.2249475 0 74 5 76 0 0 1 3 H76 0 9.1836481 -5.1423383 0 75 5 77 0 0 1 3 H77 0 9.5821762 -5.8326097 0 76 5 78 0 0 1 3 H78 0 10.123319 3.5599999 0 77 5 79 0 0 1 3 H79 0 11.526279 4.3699999 0 78 5 80 0 0 1 3 H80 0 11.526279 1.13 0 79 0 1 0 0 0 1 11 1 2 81 0 0 1 0 0 0 1 0 0 1 2 11 82 0 0 1 0 1 0 1 2 3 11 83 0 0 2 0 1 0 2 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4.155000210 C12 7.19615221 3.654999970 C13 7.19615221 2.654999970 N14 6.33012724 2.154999970C15 5.46410179 2.654999970C16 5.46410179 3.654999970C17 4.59807634 2.154999970C18 3.7320509 2.654999970C19 2.86602545 2.154999970C20 2.86602545 1.154999970Cl212 0.6549999710C22 3.7320509 0.6549999710C23 4.59807634 1.154999970Cl242 2.654999970C25 6.33012724 1.154999970O26 5.46410179 0.6549999710C27 7.19615221 0.6549999710N28 7.19615221 -0.3449999990C29 8.06217766 -0.8450000290C30 8.06217766 -1.845000030C31 8.92820358 -2.345000030N32 9.79422855 -1.845000030 C33 9.79422855 -0.8450000290!C34 8.92820358 -0.3449999990"C35 10.6602535 -2.345000030#O36 11.5262794 -1.845000030$C37 10.6602535 -3.345000030%N38 9.79422855 -3.845000030&C39 11.5262794 -3.845000030'C40 11.5262794 -4.844999790(C41 10.6602535 -5.344999790)C42 10.6602535 -6.344999790*C43 11.5262794 -6.844999790+O44 11.5262794 -7.844999790,C45 12.3923044 -6.344999790-C46 12.3923044 -5.344999790.H47 8.68217754 8.154999730/H48 8.06217766 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" !#!$"%"#&"$'$%($&)&'*'(+(),)*-*+.*,/,-0'-1.2/30415263748596: 7; 8< 9= :>;?<@=A>B?C@DAEBFCGDHEIFJGKHL IM JN!KO!LP$MQ%NR%OS&PT&QU(RV)SW+TX,UY-VZ0H00000000-0000-0000-0000-000000000000EAJa-HeY#ǜLb{` 50108259*jL)>VzAmide oxime?8aCnCJF@@?33@%Kt7& CON=C(CNC(=O)C1=C(OC)C=CC=C1)C(CCN2CCC(O)(CC2)C3=CC=CC=C3)C4=CC(=C(Cl)C=C4)Clms|uKމ_vO}bѲx^~w{9eJ1??:.</K*Ccη<}5}5OSA$9b87a504-1393-4ca9-a134-07eeba4f22bc75C1 2.86602545 -0.5490381120O2 3.7320509 -1.049038050N3 4.59807634 -0.5490381120C4 5.46410179 -1.049038050C5 5.46410179 -2.049038170N6 4.59807634 -2.549038170C7 4.59807634 -3.549038170O8 5.46410179 -4.049037930C9 3.7320509 -4.049037930 C10 3.7320509 -5.049037930 O11 4.59807634 -5.549037930 C12 4.59807634 -6.549037930 C13 2.86602545 -5.549037930 C142 -5.049037930C152 -4.049037930C16 2.86602545 -3.549038170C17 6.33012724 -0.5490381120C18 6.33012724 0.4509618880C19 5.46410179 0.9509618880N20 5.46410179 1.950961950C21 6.33012724 2.450961830C22 6.33012724 3.450961830C23 5.46410179 3.950961830O24 5.96410179 4.816987510C25 4.59807634 3.450961830C26 4.59807634 2.450961830C27 4.96410179 4.816987510C28 5.46410179 5.683012490C29 4.96410179 6.549037930C30 3.96410155 6.549037930C31 3.46410155 5.683012490C32 3.96410155 4.816987510 C33 7.19615221 -1.049038050!C34 7.19615221 -2.049038170"C35 8.06217766 -2.549038170#C36 8.92820358 -2.049038170$Cl37 9.79422855 -2.549038170%C38 8.92820358 -1.049038050&C39 8.06217766 -0.5490381120'Cl40 8.06217766 -3.549038170(H41 3.17602539 -0.01210233940)H42 2.32908964 -0.2390381540*H43 2.55602551 -1.085973860+H44 5.67615414 -2.631647590,H45 6.07468271 -1.941376330-H46 4.06114054 -2.239037990.H47 3.97807646 -6.549037930/H48 4.59807634 -7.1690378200H49 5.21807623 -6.5490379301H50 2.86602545 -6.1690378202H51 1.46306419 -5.3590378803H52 1.46306431 -3.7390379904H53 2.86602545 -2.9290382905H54 6.86706305 -0.23903815406H55 6.94070816 0.34330001507H56 6.54217958 1.0335713608H57 4.85352087 1.0586237909H58 5.25204945 0.3683524730:H59 6.54217958 1.868352410;H60 6.94070816 2.558623790<H61 6.94070816 3.343299870=H62 6.54217958 4.033571240>H63 6.58410168 4.816987510?H644.386024 4.033571240@H65 3.98749542 3.343299870AH66 3.98749542 2.558623790BH674.386024 1.868352410CH68 6.08410168 5.683012490DH69 5.27410173 7.085973740EH70 3.65410161 7.085973740FH71 2.84410167 5.683012490GH72 3.65410161 4.280051710HH73 6.6592164 -2.359038110IH74 9.46513939 -0.7390379910JH75 8.06217766 0.0709618852078          ! " !#!"$"#%#$&#%'%&( &)"'*(+),*-+.,/-0 .1 /2 03 14 25364758697:8;9<:=;><?=@>A?B@CADBECFDGEHFIGJ!HK%IL&JM0H00000000-0000-0000-0000-000000000000+~M%Z4#ǜLb{` 50120204*jL)>Vz"Phenyl piperazine?8aCnCJF@?33@%Kt7& CC1=CC(=CC(=C1)C(=O)N2CCN(C(C2)C3=CC(=C(Cl)C=C3)Cl)C(=O)CNC4CCN(CC4)CC5=C[NH]C=C5)C} vc] o{o}֙vyye?#;y[׮2~_.Ot*l4{v~k.p%lOSA$bccbb1c1-164a-4849-8ab8-cdec786f7f8277C1 9.79422855 3.770216230C2 8.92820358 4.270215990C3 8.92820358 5.270215990C4 8.06217766 5.770215990C5 7.19615221 5.270215990C6 7.19615221 4.270215990C7 8.06217766 3.770216230C8 6.33012724 3.770216230O9 5.46410179 4.270215990 N10 6.33012724 2.770216230 C11 7.19615221 2.270216230 C12 7.19615221 1.270216110 N13 6.33012724 0.7702161670 C14 5.46410179 1.270216110C15 5.46410179 2.270216230C16 4.59807634 0.7702161670C17 3.7320509 1.270216110C18 2.86602545 0.7702161670C19 2.86602545 -0.2297838330Cl202 -0.7297838330C21 3.7320509 -0.7297838330C22 4.59807634 -0.2297838330Cl232 1.270216110C24 6.33012724 -0.2297838330O25 5.46410179 -0.7297838330C26 7.19615221 -0.7297838330N27 7.19615221 -1.729783890C28 8.06217766 -2.229783770C29 8.06217766 -3.229783770C30 8.92820358 -3.729783770N31 9.79422855 -3.229783770C32 9.79422855 -2.229783770 C33 8.92820358 -1.729783890!C34 10.6602535 -3.729783770"C35 10.6602535 -4.729784010#C36 11.4692707 -5.317569260$N37 11.1602535 -6.268625740%H38 11.5246811 -6.770215990&C39 10.1602535 -6.268625740'C40 9.8512373 -5.317569260(C41 8.06217766 6.770215990)H42 9.48422813 3.233280420*H43 10.3311644 3.460216280+H44 10.104229 4.307151790,H45 9.46513939 5.580215930-H46 6.6592164 5.580215930.H47 8.06217766 3.150216340/H48 7.80673313 2.1625542600H49 7.40820456 2.8528256401H50 7.40820456 0.68760669202H51 7.80673313 1.3778780703H52 5.46410179 0.65021610304H53 5.25204945 2.8528256405H54 4.85352087 2.1625542606H55 3.7320509 1.8902161107H56 3.7320509 -1.3497837808H57 5.13501215 -0.53978383509H58 7.80673313 -0.8374457360:H59 7.40820456 -0.1471744330;H60 6.65921688 -2.039783950<H61 8.06217766 -1.609783770=H62 7.45159674 -3.122122050>H63 7.85012531 -3.812393190?H64 8.52967548 -4.204731460@H65 9.32673168 -4.204731460AH66 10.404809 -2.337445740BH67 10.0062809 -1.647174360CH68 9.32673168 -1.254836440DH69 8.52967548 -1.25483620EH70 11.2708349 -3.83744550FH71 10.8723068 -3.147174360GH72 12.0589256 -5.125978470HH73 9.79582787 -6.770216460IH74 9.26158237 -5.125978950JH75 8.68217754 6.770215990KH76 8.06217766 7.390215870LH77 7.44217777 6.77021599081              ! " #!$!"%"#&#$'$%($&)&'*"'+(,)-*.+/,0-1.2 /3 04 15 26 3748596:7;8<9=:>;?<@=A>B?C@DAEBF CG DH!EI!FJ#GK&HL'IM(JN(KO(LP0H00000000-0000-0000-0000-0000000000009IE8U1Q#ǜLb{` 50096945*jL)>Vz*Monobasic ether oxime?8aCnCJF@Ƨ?33@%Kt7& CON=C(COCC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(CCN2CCC(CC2)N3CCCC3)C4=CC=C(Cl)C(=C4)Cl&Wg]y|TLݩ\OgwwOJrVF$sS"y]SJ{>-]xO}xS]o%GǕ<3k7U722 serialization::archive 9 2 1 2 0 0 0 78 81 0 0 0 0 0 1 5 1 5 1 0 1 0 0 0 0 6 2 C1 0 0 0 8.0621777 4.5194211 0 0 5 2 0 0 8 2 O2 0 8.0621777 3.5194209 0 1 5 3 0 0 7 2 N3 0 8.9282036 3.0194209 0 2 5 4 0 0 6 2 C4 0 8.9282036 2.0194209 0 3 5 5 0 0 6 2 C5 0 8.0621777 1.5194209 0 4 5 6 0 0 8 2 O6 0 7.1961522 2.0194209 0 5 5 7 0 0 6 2 C7 0 6.3301272 1.5194209 0 6 5 8 0 0 6 2 C8 0 5.4641018 2.0194209 0 7 5 9 0 0 6 2 C9 0 5.4641018 3.0194209 0 8 5 10 0 0 6 3 C10 0 4.5980763 3.5194209 0 9 5 11 0 0 6 3 C11 0 3.7320509 3.0194209 0 10 5 12 0 0 6 3 C12 0 3.7320509 2.0194209 0 11 5 13 0 0 6 3 C13 0 4.5980763 1.5194209 0 12 5 14 0 0 6 3 C14 0 2.8660254 1.5194209 0 13 5 15 0 0 9 3 F15 0 2.3660254 2.3854463 0 14 5 16 0 0 9 3 F16 0 2 1.0194209 0 15 5 17 0 0 9 3 F17 0 3.3660254 0.65339547 0 16 5 18 0 0 6 3 C18 0 4.5980763 4.5194211 0 17 5 19 0 0 9 3 F19 0 3.5980761 4.5194211 0 18 5 20 0 0 9 3 F20 0 4.5980763 5.5194211 0 19 5 21 0 0 9 3 F21 0 5.5980763 4.5194211 0 20 5 22 0 0 6 3 C22 0 9.7942286 1.5194209 0 21 5 23 0 0 6 3 C23 0 9.7942286 0.51942086 0 22 5 24 0 0 6 3 C24 0 10.660254 0.019420885 0 23 5 25 0 0 7 3 N25 0 10.660254 -0.98057914 0 24 5 26 0 0 6 3 C26 0 9.7942286 -1.4805791 0 25 5 27 0 0 6 3 C27 0 9.7942286 -2.4805791 0 26 5 28 0 0 6 3 C28 0 10.660254 -2.9805791 0 27 5 29 0 0 6 3 C29 0 11.526279 -2.4805791 0 28 5 30 0 0 6 3 C30 0 11.526279 -1.4805791 0 29 5 31 0 0 7 3 N31 0 10.660254 -3.9805791 0 30 5 32 0 0 6 3 C32 0 9.8512373 -4.5683641 0 31 5 33 0 0 6 3 C33 0 10.160254 -5.5194211 0 32 5 34 0 0 6 3 C34 0 11.160254 -5.5194211 0 33 5 35 0 0 6 3 C35 0 11.469271 -4.5683641 0 34 5 36 0 0 6 3 C36 0 10.660254 2.0194209 0 35 5 37 0 0 6 3 C37 0 10.660254 3.0194209 0 36 5 38 0 0 6 3 C38 0 11.526279 3.5194209 0 37 5 39 0 0 6 3 C39 0 12.392304 3.0194209 0 38 5 40 0 0 17 4 Cl40 0 13.25833 3.5194209 0 39 5 41 0 0 6 3 C41 0 12.392304 2.0194209 0 40 5 42 0 0 6 3 C42 0 11.526279 1.5194209 0 41 5 43 0 0 17 4 Cl43 0 13.25833 1.5194209 0 42 5 44 0 0 1 3 H44 0 8.6821775 4.5194211 0 43 5 45 0 0 1 3 H45 0 8.0621777 5.139421 0 44 5 46 0 0 1 3 H46 0 7.4421778 4.5194211 0 45 5 47 0 0 1 3 H47 0 7.6636491 1.0444733 0 46 5 48 0 0 1 3 H48 0 8.4607058 1.0444733 0 47 5 49 0 0 1 3 H49 0 5.9315991 1.0444733 0 48 5 50 0 0 1 3 H50 0 6.7286558 1.0444734 0 49 5 51 0 0 1 3 H51 0 6.0010376 3.3294208 0 50 5 52 0 0 1 3 H52 0 3.1951151 3.3294208 0 51 5 53 0 0 1 3 H53 0 4.5980763 0.89942086 0 52 5 54 0 0 1 3 H54 0 9.2572927 1.2094209 0 53 5 55 0 0 1 3 H55 0 9.1836481 0.62708265 0 54 5 56 0 0 1 3 H56 0 9.5821762 -0.063188605 0 55 5 57 0 0 1 3 H57 0 11.270835 -0.088240929 0 56 5 58 0 0 1 3 H58 0 10.872307 0.60203034 0 57 5 59 0 0 1 3 H59 0 9.5821762 -0.89796966 0 58 5 60 0 0 1 3 H60 0 9.1836481 -1.588241 0 59 5 61 0 0 1 3 H61 0 9.1836481 -2.3729174 0 60 5 62 0 0 1 3 H62 0 9.5821762 -3.0631886 0 61 5 63 0 0 1 3 H63 0 11.19719 -3.2905791 0 62 5 64 0 0 1 3 H64 0 11.738332 -3.0631886 0 63 5 65 0 0 1 3 H65 0 12.13686 -2.3729172 0 64 5 66 0 0 1 3 H66 0 12.13686 -1.5882411 0 65 5 67 0 0 1 3 H67 0 11.738332 -0.89796972 0 66 5 68 0 0 1 3 H68 0 9.5412378 -4.0314283 0 67 5 69 0 0 1 3 H69 0 9.2848387 -4.8205409 0 68 5 70 0 0 1 3 H70 0 9.5538034 -5.6483264 0 69 5 71 0 0 1 3 H71 0 10.225062 -6.1360245 0 70 5 72 0 0 1 3 H72 0 11.095447 -6.1360245 0 71 5 73 0 0 1 3 H73 0 11.766706 -5.6483259 0 72 5 74 0 0 1 3 H74 0 12.035669 -4.8205404 0 73 5 75 0 0 1 3 H75 0 11.77927 -4.0314283 0 74 5 76 0 0 1 3 H76 0 10.123319 3.3294208 0 75 5 77 0 0 1 3 H77 0 11.526279 4.139421 0 76 5 78 0 0 1 3 H78 0 11.526279 0.89942086 0 77 0 1 0 0 0 1 11 1 2 79 0 0 1 0 0 0 1 0 0 1 2 11 80 0 0 1 0 1 0 1 2 3 11 81 0 0 2 0 1 0 2 3 4 11 82 0 0 1 0 1 0 3 4 5 11 83 0 0 1 0 1 0 4 5 6 11 84 0 0 1 0 1 0 5 6 7 11 85 0 0 1 0 1 0 6 7 8 11 86 0 0 21 0 1 1 7 8 9 11 87 0 0 20 0 1 1 8 9 10 11 88 0 0 21 0 1 1 9 10 11 11 89 0 0 20 0 1 1 10 11 12 11 90 0 0 21 0 1 1 11 7 12 11 91 0 0 20 0 1 1 12 11 13 11 92 0 0 1 0 1 0 13 13 14 11 93 0 0 1 0 1 0 14 13 15 11 94 0 0 1 0 1 0 15 13 16 11 95 0 0 1 0 1 0 16 9 17 11 96 0 0 1 0 1 0 17 17 18 11 97 0 0 1 0 1 0 18 17 19 11 98 0 0 1 0 1 0 19 17 20 11 99 0 0 1 0 1 0 20 3 21 11 100 0 0 1 0 1 0 21 21 22 11 101 0 0 1 0 1 0 22 22 23 11 102 0 0 1 0 1 0 23 23 24 11 103 0 0 1 0 1 0 24 24 25 11 104 0 0 1 0 1 1 25 25 26 11 105 0 0 1 0 1 1 26 26 27 11 106 0 0 1 0 1 1 27 27 28 11 107 0 0 1 0 1 1 28 28 29 11 108 0 0 1 0 1 1 29 24 29 11 109 0 0 1 0 1 1 30 27 30 11 110 0 0 1 0 1 0 31 30 31 11 111 0 0 1 0 1 1 32 31 32 11 112 0 0 1 0 1 1 33 32 33 11 113 0 0 1 0 1 1 34 33 34 11 114 0 0 1 0 1 1 35 30 34 11 115 0 0 1 0 1 1 36 21 35 11 116 0 0 1 0 1 0 37 35 36 11 117 0 0 21 0 1 1 38 36 37 11 118 0 0 20 0 1 1 39 37 38 11 119 0 0 21 0 1 1 40 38 39 11 120 0 0 1 0 1 0 41 38 40 11 121 0 0 20 0 1 1 42 40 41 11 122 0 0 21 0 1 1 43 35 41 11 123 0 0 20 0 1 1 44 40 42 11 124 0 0 1 0 1 0 45 0 43 11 125 0 0 1 0 1 0 46 0 44 11 126 0 0 1 0 1 0 47 0 45 11 127 0 0 1 0 1 0 48 4 46 11 128 0 0 1 0 1 0 49 4 47 11 129 0 0 1 0 1 0 50 6 48 11 130 0 0 1 0 1 0 51 6 49 11 131 0 0 1 0 1 0 52 8 50 11 132 0 0 1 0 1 0 53 10 51 11 133 0 0 1 0 1 0 54 12 52 11 134 0 0 1 0 1 0 55 21 53 11 135 0 0 1 0 1 0 56 22 54 11 136 0 0 1 0 1 0 57 22 55 11 137 0 0 1 0 1 0 58 23 56 11 138 0 0 1 0 1 0 59 23 57 11 139 0 0 1 0 1 0 60 25 58 11 140 0 0 1 0 1 0 61 25 59 11 141 0 0 1 0 1 0 62 26 60 11 142 0 0 1 0 1 0 63 26 61 11 143 0 0 1 0 1 0 64 27 62 11 144 0 0 1 0 1 0 65 28 63 11 145 0 0 1 0 1 0 66 28 64 11 146 0 0 1 0 1 0 67 29 65 11 147 0 0 1 0 1 0 68 29 66 11 148 0 0 1 0 1 0 69 31 67 11 149 0 0 1 0 1 0 70 31 68 11 150 0 0 1 0 1 0 71 32 69 11 151 0 0 1 0 1 0 72 32 70 11 152 0 0 1 0 1 0 73 33 71 11 153 0 0 1 0 1 0 74 33 72 11 154 0 0 1 0 1 0 75 34 73 11 155 0 0 1 0 1 0 76 34 74 11 156 0 0 1 0 1 0 77 36 75 11 157 0 0 1 0 1 0 78 37 76 11 158 0 0 1 0 1 0 79 41 77 11 159 0 0 1 0 1 0 80 3008de9a-df83-4d70-8efa-0a64fe5e26e9 0 1 0 0 0 1H00000000-0000-0000-0000-000000000000zKib_G8+#ǜLb{` 50096934*jL)>Vz*Monobasic ether oxime?8aCnCJF@?33@%Kt7& CON=C(COCC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(CCN2CCC(CC2)CN3CCCC(O)C3)C4=CC=C(Cl)C(=C4)Cl.WeUy|Tߩ]Ogww^jrVF[${S"y]SJs>-]xO}xS]oGƕ<3k77OSA$fc884991-ccf3-4474-84a6-788230fa386f85C1 8.06217766 5.405000210O2 8.06217766 4.405000210N3 8.92820358 3.904999970C4 8.92820358 2.904999970C5 8.06217766 2.404999970O6 7.19615221 2.904999970C7 6.33012724 2.404999970C8 5.46410179 2.904999970C9 5.46410179 3.904999970 C10 4.59807634 4.405000210 C11 3.7320509 3.904999970 C12 3.7320509 2.904999970 C13 4.59807634 2.404999970 C14 2.86602545 2.404999970 F15 2.36602545 3.271025420 F162 1.904999970 F17 3.36602545 1.538974640C18 4.59807634 5.405000210 F19 3.59807611 5.405000210 F20 4.59807634 6.405000210 F21 5.59807634 5.405000210C22 9.79422855 2.404999970C23 9.79422855 1.404999970C24 10.6602535 0.9049999710N25 10.6602535 -0.09499999880C26 9.79422855 -0.5950000290C27 9.79422855 -1.595000030C28 10.6602535 -2.095000030C29 11.5262794 -1.595000030C30 11.5262794 -0.5950000290C31 10.6602535 -3.095000030N32 11.5262794 -3.595000030 C33 12.3923044 -3.095000030!C34 13.2583303 -3.595000030"C35 13.2583303 -4.594999790#C36 12.3923044 -5.094999790$O37 12.3923044 -6.094999790%C38 11.5262794 -4.594999790&C39 10.6602535 2.904999970'C40 10.6602535 3.904999970(C41 11.5262794 4.405000210)C42 12.3923044 3.904999970*Cl43 13.2583303 4.405000210+C44 12.3923044 2.904999970,C45 11.5262794 2.404999970-Cl46 13.2583303 2.404999970.H47 8.68217754 5.405000210/H48 8.06217766 6.025000100H49 7.44217777 5.4050002101H50 7.66364908 1.930052402H51 8.46070576 1.930052403H52 5.93159914 1.930052404H53 6.72865582 1.9300525205H54 6.0010376 4.2150001506H55 3.19511509 4.2150001507H56 4.59807634 1.7849999708H57 9.25729275 2.0950000309H58 9.18364811 1.512661810:H59 9.58217621 0.8223904970;H60 11.2708349 0.7973381280<H61 10.8723068 1.487609390=H62 9.58217621 -0.0123905670>H63 9.18364811 -0.7026618720?H64 9.18364811 -1.487338190@H65 9.58217621 -2.177609440AH66 11.1971903 -2.404999970BH67 11.7383318 -2.177609440CH68 12.1368599 -1.487338070DH69 12.1368599 -0.7026619320EH70 11.7383318 -0.0123906340FH71 10.049674 -2.987338070GH72 10.4482021 -3.677609440HH73 12.7908325 -2.620052340IH74 11.9937763 -2.620052580JH75 13.8689108 -3.702661750KH76 13.4703827 -3.012390610LH77 13.4703827 -5.177609440MH78 13.8689108 -4.487338070NH79 11.8553686 -5.404999730OH80 12.9292402 -6.405000210PH81 10.915699 -4.487338070QH82 11.3142271 -5.177608970RH83 10.1233187 4.214999680SH84 11.5262794 5.02500010TH85 11.5262794 1.78499997088                ! !"!"#"#$#$%#%&%'&(&')'(*()+)*,)+-+,.&,/+-0.1/2031425364758 69 7:8;9<:=;><?=@>A?B@CADBECFDGEHFIGJ HK IL!JM!KN"LO"MP#NQ$OR%PS%QT'RU(SV,TW0H00000000-0000-0000-0000-000000000000ȵ0WBe< vqW#ǜLb{` 50093101*jL)>Vz&Dibasic ether oxime?8aCnCJF@?33@%Kt7& CCOCCCNC(=O)CN1CCN(CCC(C(COCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)=NOC)C3=CC(=C(Cl)C=C3)Cl)CC1&WeUy}ULݹ\gwwJzVFtSsy]sHsVz"Phenyl piperazine?8aCnCJF@ @?33@%Kt7& CC1=CC(=CC(=C1)C)C(=O)N2CCN(C(C2)C3=CC(=C(Cl)C=C3)Cl)C(=O)CNC4CCN(CC4)C(=O)C(N)C5=CC=CC=C5ӻ}vsk]yk?_Ǡ;ORҙvye?#;/}[O' ~_/>{O|Ц*l>ߞ+v뗒~p%Vlk(OSA$34911c16-cdca-4c84-80e7-1a94b122211783C1 8.062177666.750C2 8.062177665.750C3 7.196152215.250C4 7.196152214.250C5 8.062177663.750C6 8.928203584.250C7 8.928203585.250C8 9.794228553.750C9 6.330127243.750 O10 5.464101794.250 N11 6.330127242.750 C12 7.196152212.250 C13 7.196152211.250 N14 6.330127240.750C15 5.464101791.250C16 5.464101792.250C17 4.598076340.750C18 3.73205091.250C19 2.866025450.750C20 2.86602545-0.250Cl212-0.750C22 3.7320509-0.750C23 4.59807634-0.250Cl2421.250C25 6.33012724-0.250O26 5.46410179-0.750C27 7.19615221-0.750N28 7.19615221-1.750C29 8.06217766-2.250C30 8.06217766-3.250C31 8.92820358-3.750N32 9.79422855-3.250 C33 9.79422855-2.250!C34 8.92820358-1.750"C35 10.6602535-3.750#O36 11.5262794-3.250$C37 10.6602535-4.750%N38 9.79422855-5.250&C39 11.5262794-5.250'C40 11.5262794-6.250(C41 12.3923044-6.750)C42 13.2583303-6.250*C43 13.2583303-5.250+C44 12.3923044-4.750,H45 8.682177546.750-H46 8.06217766 7.369999890.H47 7.442177776.750/H48 6.6592164 5.5599999400H49 8.06217766 3.1300001101H50 9.46513939 5.5599999402H51 9.48422813 3.2130644303H52 10.3311644 3.4399998204H53 10.104229 4.2869358105H54 7.80673313 2.1423380406H55 7.40820456 2.8326094207H56 7.40820456 0.66739058508H57 7.80673313 1.3576619609H58 5.46410179 0.6299999950:H59 5.25204945 2.832609420;H60 4.85352087 2.142338040<H61 3.73205091.870=H62 3.7320509-1.370>H63 5.13501215 -0.5600000020?H64 7.80673313 -0.8576619030@H65 7.40820456 -0.16739060AH66 6.65921688 -2.059999940BH67 8.06217766-1.630CH68 7.45159674 -3.142338280DH69 7.85012531 -3.832609420EH70 8.52967548 -4.224947450FH71 9.32673168 -4.224947450GH72 10.404809 -2.357661960HH73 10.0062809 -1.667390580IH74 9.32673168 -1.275052550JH75 8.52967548 -1.275052310KH76 10.6602535 -5.369999890LH77 9.25729275 -4.940000060MH78 9.79422855 -5.869999890NH79 10.9893436 -6.559999940OH80 12.3923044 -7.369999890PH81 13.7952662 -6.559999940QH82 13.7952662 -4.940000060RH83 12.3923044 -4.13000011087             ! " !#!$"%"#&"$'$%($&)&'*'(+(),)*-*+.&+/,0-1.2/30415263748 59 6: 7; 8<9=:>;?<@=A>B?C@DAEBFCGDHEIFJ GK HL!IM!JN$KO%LP%MQ'NR(OS)PT*QU+RV0H00000000-0000-0000-0000-000000000000V@2kN9&<+=#ǜLb{` 50096939*jL)>Vz*Monobasic ether oxime?8aCnCJF@m`?33@%Kt7& CON=C(COCC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(CCN2CCC(CC2)NC(=O)C3CCCCC3)C4=CC=C(Cl)C(=C4)ClWg]y|VLߩ\OgwwJrwF$ss"y]SJ{>-_xO}xW_o%Gߕ>;7U7{OSA$ce07e12f-8708-4510-a1bd-d3a0f30d0cde86C1 8.062177665.50O2 8.062177664.50N3 8.9282035840C4 8.9282035830C5 8.062177662.50O6 7.1961522130C7 6.330127242.50C8 5.4641017930C9 5.4641017940 C10 4.598076344.50 C11 3.732050940 C12 3.732050930 C13 4.598076342.50 C14 2.866025452.50 F15 2.36602545 3.366025450 F16220 F17 3.36602545 1.633974550C18 4.598076345.50 F19 3.598076115.50 F20 4.598076346.50 F21 5.598076345.50C22 9.794228552.50C23 9.794228551.50C24 10.660253510N25 10.6602535-3.55271368e-0150C26 9.79422855-0.50C27 9.79422855-1.50C28 10.6602535-20C29 11.5262794-1.50C30 11.5262794-0.50N31 10.6602535-30C32 11.5262794-3.50 O33 12.3923044-30!C34 11.5262794-4.50"C35 10.6602535-50#C36 10.6602535-60$C37 11.5262794-6.50%C38 12.3923044-60&C39 12.3923044-50'C40 10.660253530(C41 10.660253540)C42 11.52627944.50*C43 12.392304440+Cl44 13.25833034.50,C45 12.392304430-C46 11.52627942.50.Cl47 13.25833032.50/H48 8.682177545.500H49 8.06217766 6.1199998901H50 7.442177775.502H51 7.66364908 2.0250525503H52 8.46070576 2.0250523104H53 5.93159914 2.0250523105H54 6.72865582 2.0250525506H55 6.0010376 4.3099999407H56 3.19511509 4.3099999408H57 4.598076341.8809H58 9.25729275 2.190000060:H59 9.18364811 1.607661840;H60 9.58217621 0.9173905250<H61 11.2708349 0.8923381570=H62 10.8723068 1.582609420>H63 9.58217621 0.08260945980?H64 9.18364811 -0.6076618430@H65 9.18364811 -1.392338160AH66 9.58217621 -2.082609420BH67 11.1971903 -2.309999940CH68 11.7383318 -2.082609420DH69 12.1368599 -1.392338040EH70 12.1368599 -0.6076619030FH71 11.7383318 0.08260939270GH72 10.1233187 -3.309999940HH73 12.0632153 -4.190000060IH74 10.4482021 -4.417390820JH75 10.049674 -5.107661720KH76 10.049674 -5.892338280LH77 10.4482021 -6.582609180MH78 11.1277514 -6.974947450NH79 11.9248075 -6.974947450OH80 12.6043568 -6.582609180PH81 13.0028849 -5.892338280QH82 13.0028849 -5.107661720RH83 12.6043568 -4.417390820SH84 10.1233187 4.309999940TH85 11.5262794 5.119999890UH86 11.52627941.88089                !!"!"#"#$#$%$%&%&'!&(')'(*()+)*,*+-*,.,-/'-0,.1/203142536475869 7: 8;9<:=;><?=@>A?B@CADBECFDGEHFIGJ!HK"IL"JM#KN#LO$MP$NQ%OR%PS&QT&RU(SV)TW-UX0H00000000-0000-0000-0000-000000000000BgxwAm>w#ǜLb{` 50110659*jL)>Vz*Monobasic ether oxime?8aCnCJF@=p?33@%Kt7& COCON=C(COCC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(CCN2CCC(O)(CC2)C3=CC=CC=C3)C4=CC=C(Cl)C(=C4)Cl&WeUUL]ogwNʯr^VdsS"y]SJs>-]|Oߩ}xW]o%GƟ77Uw3OSA$3708096a-576c-4825-a22c-84cb7a15261381C1 8.92820358 5.799037930O2 8.92820358 4.799037930C3 8.06217766 4.299037930O4 8.06217766 3.299038170N5 8.92820358 2.799038170C6 8.92820358 1.799038050C7 8.06217766 1.299038050O8 7.19615221 1.799038050C9 6.33012724 1.299038050 C10 5.46410179 1.799038050 C11 5.46410179 2.799038170 C12 4.59807634 3.299038170 C13 3.7320509 2.799038170 C14 3.7320509 1.799038050C15 4.59807634 1.299038050C16 2.86602545 1.299038050 F17 2.36602545 2.165063620 F182 0.7990381120 F19 3.36602545 0.4330126940C20 4.59807634 4.299037930 F21 3.59807611 4.299037930 F22 4.59807634 5.299037930 F23 5.59807634 4.299037930C24 9.79422855 1.299038050C25 9.79422855 0.2990381120C26 10.6602535 -0.2009618880N27 10.6602535 -1.200961950C28 9.79422855 -1.700961950C29 9.79422855 -2.700961830C30 10.6602535 -3.200961830O31 10.1602535 -4.066987510C32 11.5262794 -2.700961830 C33 11.5262794 -1.700961950!C34 11.1602535 -4.066987510"C35 10.6602535 -4.933012490#C36 11.1602535 -5.799037930$C37 12.1602535 -5.799037930%C38 12.6602535 -4.933012490&C39 12.1602535 -4.066987510'C40 10.6602535 1.799038050(C41 10.6602535 2.799038170)C42 11.5262794 3.299038170*C43 12.3923044 2.799038170+Cl44 13.2583303 3.299038170,C45 12.3923044 1.799038050-C46 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CCOC(=O)C1CCCN(C1)C2CCN(CC2)CCC(C(COCC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)=NOC)C4=CC=C(Cl)C(=C4)Cl'Wg]y|WLݩܩOgwJrVNfss"y]SJ{>-ݹO}xS]o%Wǵ<;k7U7BOSA$eb6865d2-dde8-4421-91e9-61cdbfe238e190C1 8.06217766-70C2 8.06217766-60O3 8.92820358-5.50C4 8.92820358-4.50O5 8.06217766-40C6 9.79422855-40C7 10.6602535-4.50C8 11.5262794-40C9 11.5262794-30 N10 10.6602535-2.50 C11 9.79422855-30 C12 10.6602535-1.50 C13 11.5262794-10 C14 11.5262794-1.24344979e-0140N15 10.66025350.50C16 9.79422855-9.76996262e-0150C17 9.79422855-10C18 10.66025351.50C19 9.7942285520C20 9.7942285530C21 8.928203583.50C22 8.0621776630O23 7.196152213.50C24 6.3301272430C25 5.464101793.50C26 5.464101794.50C27 4.5980763450C28 3.73205094.50C29 3.73205093.50C30 4.5980763430C31 2.8660254530 F32 2.36602545 3.866025450 F3322.50 !F34 3.36602545 2.133974550"C35 4.5980763460 #F36 3.5980761160 $F37 4.5980763470 %F38 5.5980763460&N39 8.928203584.50'O40 8.0621776650(C41 8.0621776660)C42 10.66025353.50*C43 10.66025354.50+C44 11.526279450,C45 12.39230444.50-Cl46 13.258330350.C47 12.39230443.50/C48 11.5262794300Cl49 13.2583303301H50 7.44217777-702H51 8.06217766 -7.6199998903H52 8.68217754-704H53 7.85012531 -5.4173903505H54 7.45159674 -6.1076617206H55 9.25729275 -3.6900000607H56 10.2617264 -4.9749474508H57 11.0587826 -4.9749474509H58 11.7383318 -4.582609180:H59 12.1368599 -3.892338040;H60 12.1368599 -3.107661960<H61 11.7383318 -2.417390580=H62 9.58217621 -2.417390580>H63 9.18364811 -3.107661720?H64 11.1971903 -1.809999940@H65 11.7383318 -1.582609420AH66 12.1368599 -0.8923380970BH67 12.1368599 -0.1076619180CH68 11.7383318 0.5826094150DH69 9.58217621 0.5826094750EH70 9.18364811 -0.1076618130FH71 9.18364811 -0.8923381570GH72 9.58217621 -1.582609420HH73 11.2708349 1.392338160IH74 10.8723068 2.082609420JH75 9.18364811 2.107661720KH76 9.58217621 1.417390580LH77 9.25729275 2.690000060MH78 7.66364908 2.525052550NH79 8.46070576 2.525052310OH80 5.93159914 2.525052310PH81 6.72865582 2.525052550QH82 6.0010376 4.809999940RH83 3.19511509 4.809999940SH84 4.59807634 2.380000110TH85 8.6821775460UH86 8.06217766 6.619999890VH87 7.4421777760WH88 10.1233187 4.809999940XH89 11.5262794 5.619999890YH90 11.5262794 2.38000011093             ! "!#"$"#%"$&"%'&(&')'(*)+)*,*+-+,.,-/,.0./1)/2.031425364758697:8;9<:=;><? =@ >A ?B @C AD BE CFDGEHFIGJHKILJMKNLOMPNQORPSQTRUSV(TW(UX(VY*WZ+X[/Y\0H00000000-0000-0000-0000-000000000000qO؈3cʡV#ǜLb{` 50099632*jL)>VzQuinoline?8aCnCJF@?33@%Kt7& CC(C)C(NC(=O)C1=C2C=CC=CC2=NC(=C1CN3CCN(CC3)C(C)C)C4=CC=CC=C4)C5=CC=CC=C5/R WwK"/ BiO;k*Rsgf~?736c ^ˤլ:޸pVz&Dibasic ether oxime?8aCnCJF@?33@%Kt7& CON=C(COCC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(CCN2CCN(CC2)CC(=O)N3CCC4=C(C3)C=CC=C4)C5=CC(=C(Cl)C=C5)Clu{T]gwJ~O?w}}s}]x_oϲߗ>t?u?OSA$2a4b1709-805d-43ce-909c-66c8b38ee95389C1 8.06217766 -1.334317920O2 7.19615221 -0.8343179230N3 7.19615221 0.1656820630C4 6.33012724 0.6656820770C5 5.46410179 0.1656820630O6 5.46410179 -0.8343179230C7 4.59807634 -1.334317920C8 4.59807634 -2.334317920C9 3.7320509 -2.834317920 C10 3.7320509 -3.834317920 C11 4.59807634 -4.334318160 C12 5.46410179 -3.834317920 C13 5.46410179 -2.834317920 C14 6.33012724 -4.334318160 F15 6.83012724 -3.468292470 F16 7.19615221 -4.834318160 F17 5.83012724 -5.200343130C18 2.86602545 -4.334318160 F19 2.36602545 -3.468292470 F202 -4.834318160 F21 3.36602545 -5.200343130C22 6.33012724 1.665682080C23 7.19615221 2.165682080C24 8.06217766 1.665682080N25 8.92820358 2.165682080C26 9.79422855 1.665682080C27 10.6602535 2.165682080N28 10.6602535 3.165682080C29 9.79422855 3.665682080C30 8.92820358 3.165682080C31 11.5262794 3.665682080C32 12.3923044 3.165682080 O33 12.3923044 2.165682080!N34 13.2583303 3.665682080"C35 13.2583303 4.665681840#C36 14.1243553 5.165681840$C37 14.9903812 4.665681840%C38 14.9903812 3.665682080&C39 14.1243553 3.165682080'C40 15.8843231 3.131020780(C4116.79039 3.64486670)C4216.79039 4.686497690*C43 15.8843231 5.200343130+C44 5.46410179 2.165682080,C45 5.46410179 3.165682080-C46 4.59807634 3.665682080.C47 3.7320509 3.165682080/Cl48 2.86602545 3.6656820800C49 3.7320509 2.1656820801C50 4.59807634 1.6656820802Cl51 4.59807634 4.6656818403H52 7.75217772 -1.8712537304H53 8.59911346 -1.6443178705H54 8.37217808 -0.79738217606H55 5.25204945 0.74829149207H56 4.85352087 0.058020196908H574.386024 -0.75170850809H58 3.98749542 -1.441979770:H59 3.19511509 -2.524317980;H60 4.59807634 -4.954318050<H61 6.0010376 -2.524317980=H62 6.86706305 1.355682130>H63 7.59468031 2.640629770?H64 6.79762363 2.640629530@H65 7.66364908 1.190734510AH66 8.46070576 1.190734510BH67 9.39570045 1.190734620CH68 10.1927567 1.190734390DH69 10.8723068 1.583072660EH70 11.2708349 2.27334380FH71 10.1927567 4.140629770GH72 9.39570045 4.140629770HH73 8.71615124 3.748291490IH74 8.31762314 3.058020110JH75 11.9248075 4.140629770KH76 11.1277514 4.140629770LH77 13.046278 5.248291020MH78 12.6477499 4.558020110NH79 14.5228834 5.640629290OH80 13.7258272 5.640629290PH81 13.7258272 2.690734620QH82 14.5228834 2.690734390RH83 15.8771544 2.511062150SH84 17.3261261 3.332799430TH85 17.3261261 4.99856520UH86 15.8771534 5.820301530VH87 6.0010376 3.475682020WH88 3.19511509 1.855682020XH89 4.59807634 1.04568207093                !!"!"#"#$#$%$%&%&'!&(%')'(*()+)*,$*-+.+,/,-0-.1./2.03014+15-263748596:7;8<9=:> ;? <@=A>B?C@DAEBFCGDHEIFJGKHLIMJNKO"LP"MQ#NR#OS&PT&QU'RV(SW)TX*UY,VZ0W[1X\0H00000000-0000-0000-0000-000000000000O-``H)!yb#ǜLb{` 50093121*jL)>Vz&Dibasic ether oxime?8aCnCJF@?33@%Kt7& CON=C(COCC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(CCN2CCN(CC2)CC(=O)NC3=CC=CC=C3)C4=CC(=C(Cl)C=C4)Cl&w}TLݹ\ww^~vG4Sy]hs>UOmxsoǗ>4]?OSA$dc59fc1e-55c6-4244-80ee-599eab6aaaf082C1 8.062177665.50O2 8.062177664.50N3 8.9282035840C4 8.9282035830C5 8.062177662.50O6 7.1961522130C7 6.330127242.50C8 5.4641017930C9 5.4641017940 C10 4.598076344.50 C11 3.732050940 C12 3.732050930 C13 4.598076342.50 C14 2.866025452.50 F15 2.36602545 3.366025450 F16220 F17 3.36602545 1.633974550C18 4.598076345.50 F19 3.598076115.50 F20 4.598076346.50 F21 5.598076345.50C22 9.794228552.50C23 9.794228551.50C24 10.660253510N25 10.6602535-3.55271368e-0150C26 9.79422855-0.50C27 9.79422855-1.50N28 10.6602535-20C29 11.5262794-1.50C30 11.5262794-0.50C31 10.6602535-30C32 11.5262794-3.50 O33 12.3923044-30!N34 11.5262794-4.50"C35 12.3923044-50#C36 12.3923044-60$C37 13.2583303-6.50%C38 14.1243553-60&C39 14.1243553-50'C40 13.2583303-4.50(C41 10.660253530)C42 11.52627942.50*C43 12.392304430+C44 12.392304440,Cl45 13.25833034.50-C46 11.52627944.50.C47 10.660253540/Cl48 13.25833032.500H49 8.682177545.501H50 8.06217766 6.1199998902H51 7.442177775.503H52 7.66364908 2.0250525504H53 8.46070576 2.0250523105H54 5.93159914 2.0250523106H55 6.72865582 2.0250525507H56 6.0010376 4.3099999408H57 3.19511509 4.3099999409H58 4.598076341.880:H59 9.25729275 2.190000060;H60 9.18364811 1.607661840<H61 9.58217621 0.9173905250=H62 11.2708349 0.8923381570>H63 10.8723068 1.582609420?H64 9.58217621 0.08260945980@H65 9.18364811 -0.6076618430AH66 9.18364811 -1.392338160BH67 9.58217621 -2.082609420CH68 11.7383318 -2.082609420DH69 12.1368599 -1.392338040EH70 12.1368599 -0.6076619030FH71 11.7383318 0.08260939270GH72 10.049674 -2.892338040HH73 10.4482021 -3.582609420IH74 10.9893436 -4.809999940JH75 11.8553686 -6.309999940KH76 13.2583303 -7.119999890LH77 14.6612911 -6.309999940MH78 14.6612911 -4.690000060NH79 13.2583303 -3.880000110OH80 11.52627941.880PH81 11.5262794 5.119999890QH82 10.1233187 4.30999994085                !!"!"#"#$#$%$%&%&'&'("')(*()+)*,*+-+,.+-/-.0(.1*/2031425364758697: 8; 9<:=;><?=@>A?B@CADBECFDGEHFIGJHK!IL#JM$KN%LO&MP'NQ)OR-PS.QT0H00000000-0000-0000-0000-000000000000Ô>Ev~Qȟ#ǜLb{` 50159831*jL)>VzPeptide urea?8aCnCJF@C?33@%Kt7& FC1=CC=C(SC2=CC=C(NC(=O)NC(CC3=CC=CC=C3)C(=O)NCCCN4CCOCC4)C=C2)C=C1uMv1Ԯ|ygه+|jsz{mE)<3uM`6{B%ƾzj)סCvV)uOSA$b3dbfa7d-a4bb-4d3a-9a4e-409288ad20fb71 F1 10.6602535-70C2 9.79422855-6.50C3 9.79422855-5.50C4 8.92820358-50C5 8.06217766-5.50S6 7.19615221-50C7 7.19615221-40C8 8.06217766-3.50C9 8.06217766-2.50 C10 7.19615221-20 N11 7.19615221-10 C12 6.33012724-0.50 O13 5.46410179-10 N14 6.330127240.50C15 5.4641017910C16 4.598076340.50C17 3.732050910C18 3.732050920C19 2.866025452.50C20220C21210C22 2.866025450.50C23 5.4641017920O24 4.598076342.50N25 6.330127242.50C26 6.330127243.50C27 7.1961522140C28 7.1961522150N29 8.062177665.50C30 8.9282035850C31 9.794228555.50O32 9.794228556.50 C33 8.9282035870!C34 8.062177666.50"C35 6.33012724-2.50#C36 6.33012724-3.50$C37 8.06217766-6.50%C38 8.92820358-70&H39 10.3311644 -5.190000060'H40 8.92820358 -4.380000110(H41 8.59911346 -3.809999940)H42 8.59911346 -2.190000060*H43 7.73308802 -0.6899999980+H44 6.86706257 0.8100000020,H45 5.46410179 0.3799999950-H46 4.19954824 0.02505244310.H47 4.99660444 0.02505244310/H48 4.2689867 2.3099999400H49 2.86602545 3.1199998901H50 1.46306419 2.3099999402H51 1.46306419 0.68999999803H52 2.86602545 -0.11999999704H53 6.86706257 2.1900000605H54 6.11807489 4.0826091806H55 5.71954632 3.3923380407H56 7.40820456 3.4173905808H57 7.80673313 4.1076617209H58 6.98409986 5.582609650:H59 6.58557129 4.892338280;H60 8.52967548 4.525052550<H61 9.32673168 4.525052550=H62 10.0062809 4.917390820>H63 10.404809 5.607661720?H64 9.32673168 7.474947450@H65 8.52967548 7.474947450AH66 7.85012531 7.082609650BH67 7.45159674 6.392338280CH68 5.79319143 -2.190000060DH69 5.79319143 -3.809999940EH70 7.52524185 -6.809999940FH71 8.92820358 -7.61999989074          !!!" 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.1/2031425364758697:8;9<:=;><?=@>A?B@CAD BE!CF"DG#EH$FI0H00000000-0000-0000-0000-000000000000B- #ǜLb{` 50159841*jL)>VzPeptide urea?8aCnCJF@49`?33@%Kt7& FC1=CC(=CC(=C1)COC2=CC=C(NC(=O)NC(CC3=CC=CC=C3)C(=O)NCCCN4CCOCC4)C=C2)FuM6Ƒ־Zq]+e_Z{{}{)m3MuMb{)4ƿjӣݗG ϷWvwIOSA$b8f03efe-c93a-413f-8c5f-d8f36541089f74 F1 6.33012724-7.750C2 7.19615221-7.250C3 8.06217766-7.750C4 8.92820358-7.250C5 8.92820358-6.250C6 8.06217766-5.750C7 7.19615221-6.250C8 8.06217766-4.750O9 7.19615221-4.250 C10 7.19615221-3.250 C11 8.06217766-2.750 C12 8.06217766-1.750 C13 7.19615221-1.250 N14 7.19615221-0.250C15 6.330127240.250O16 5.46410179-0.250N17 6.330127241.250C18 5.464101791.750C19 4.598076341.250C20 3.73205091.750C21 3.73205092.750C22 2.866025453.250C2322.750C2421.750C25 2.866025451.250C26 5.464101792.750O27 4.598076343.250N28 6.330127243.250C29 6.330127244.250C30 7.196152214.750C31 7.196152215.750N32 8.062177666.250 C33 8.928203585.750!C34 9.794228556.250"O35 9.794228557.250#C36 8.928203587.750$C37 8.062177667.250%C38 6.33012724-1.750&C39 6.33012724-2.750 'F40 9.79422855-7.750(H41 8.06217766 -8.369999890)H42 9.46513939 -5.940000060*H43 6.6592164 -5.940000060+H44 8.6727581 -4.857661720,H458.27423 -4.167390350-H46 8.59911346 -3.059999940.H47 8.59911346 -1.439999940/H48 7.73308802 0.059999998700H49 6.86706257 1.5599999401H50 5.464101791.1302H51 4.19954824 0.77505242803H52 4.99660444 0.77505242804H53 4.2689867 3.0599999405H54 2.86602545 3.8699998906H55 1.46306419 3.0599999407H56 1.46306419 1.4399999408H57 2.86602545 0.62999999509H58 6.86706257 2.940000060:H59 6.11807489 4.832609180;H60 5.71954632 4.142338280<H61 7.40820456 4.167390820=H62 7.80673313 4.857661720>H63 6.98409986 6.332609650?H64 6.58557129 5.642338280@H65 8.52967548 5.275052550AH66 9.32673168 5.275052550BH67 10.0062809 5.667390820CH68 10.404809 6.357661720DH69 9.32673168 8.224947930EH70 8.52967548 8.224947930FH71 7.85012531 7.832609650GH72 7.45159674 7.142338280HH73 5.79319143 -1.440000060IH74 5.79319143 -3.05999994077           ! !"!"#"#$#$%$& %'%&( &)'*(+),*-+.,/ -0 .1 /2031425364758697:8;9<:=;><?=@>A?B @C AD!BE!CF#DG#EH$FI$GJ%HK&IL0H00000000-0000-0000-0000-000000000000IsY/N#ǜLb{` 50159844*jL)>VzPeptide urea?8aCnCJF@hr?33@%Kt7& CC1=CC=C(COC2=CC=C(NC(=O)NC(CC3=CC=CC=C3)C(=O)NCCCN4CCOCC4)C=C2)C=C1u}M6Ʊ֮Zq+e_{{}Ekj9l3ܵMuMbz90ƿVjӣݗG ηwv7f22 serialization::archive 9 2 1 2 0 0 0 77 80 0 0 0 0 0 1 5 1 5 1 0 1 0 0 0 0 6 2 C1 0 0 0 8.0621777 -8.25 0 0 5 2 0 0 6 2 C2 0 8.0621777 -7.25 0 1 5 3 0 0 6 2 C3 0 7.1961522 -6.75 0 2 5 4 0 0 6 2 C4 0 7.1961522 -5.75 0 3 5 5 0 0 6 2 C5 0 8.0621777 -5.25 0 4 5 6 0 0 6 2 C6 0 8.0621777 -4.25 0 5 5 7 0 0 8 2 O7 0 7.1961522 -3.75 0 6 5 8 0 0 6 2 C8 0 7.1961522 -2.75 0 7 5 9 0 0 6 2 C9 0 8.0621777 -2.25 0 8 5 10 0 0 6 3 C10 0 8.0621777 -1.25 0 9 5 11 0 0 6 3 C11 0 7.1961522 -0.75 0 10 5 12 0 0 7 3 N12 0 7.1961522 0.25 0 11 5 13 0 0 6 3 C13 0 6.3301272 0.75 0 12 5 14 0 0 8 3 O14 0 5.4641018 0.25 0 13 5 15 0 0 7 3 N15 0 6.3301272 1.75 0 14 5 16 0 0 6 3 C16 0 5.4641018 2.25 0 15 5 17 0 0 6 3 C17 0 4.5980763 1.75 0 16 5 18 0 0 6 3 C18 0 3.7320509 2.25 0 17 5 19 0 0 6 3 C19 0 3.7320509 3.25 0 18 5 20 0 0 6 3 C20 0 2.8660254 3.75 0 19 5 21 0 0 6 3 C21 0 2 3.25 0 20 5 22 0 0 6 3 C22 0 2 2.25 0 21 5 23 0 0 6 3 C23 0 2.8660254 1.75 0 22 5 24 0 0 6 3 C24 0 5.4641018 3.25 0 23 5 25 0 0 8 3 O25 0 4.5980763 3.75 0 24 5 26 0 0 7 3 N26 0 6.3301272 3.75 0 25 5 27 0 0 6 3 C27 0 6.3301272 4.75 0 26 5 28 0 0 6 3 C28 0 7.1961522 5.25 0 27 5 29 0 0 6 3 C29 0 7.1961522 6.25 0 28 5 30 0 0 7 3 N30 0 8.0621777 6.75 0 29 5 31 0 0 6 3 C31 0 8.9282036 6.25 0 30 5 32 0 0 6 3 C32 0 9.7942286 6.75 0 31 5 33 0 0 8 3 O33 0 9.7942286 7.75 0 32 5 34 0 0 6 3 C34 0 8.9282036 8.25 0 33 5 35 0 0 6 3 C35 0 8.0621777 7.75 0 34 5 36 0 0 6 3 C36 0 6.3301272 -1.25 0 35 5 37 0 0 6 3 C37 0 6.3301272 -2.25 0 36 5 38 0 0 6 3 C38 0 8.9282036 -5.75 0 37 5 39 0 0 6 3 C39 0 8.9282036 -6.75 0 38 5 40 0 0 1 3 H40 0 7.4421778 -8.25 0 39 5 41 0 0 1 3 H41 0 8.0621777 -8.8699999 0 40 5 42 0 0 1 3 H42 0 8.6821775 -8.25 0 41 5 43 0 0 1 3 H43 0 6.6592164 -7.0599999 0 42 5 44 0 0 1 3 H44 0 6.6592164 -5.4400001 0 43 5 45 0 0 1 3 H45 0 8.6727581 -4.3576617 0 44 5 46 0 0 1 3 H46 0 8.27423 -3.6673906 0 45 5 47 0 0 1 3 H47 0 8.5991135 -2.5599999 0 46 5 48 0 0 1 3 H48 0 8.5991135 -0.94 0 47 5 49 0 0 1 3 H49 0 7.733088 0.56 0 48 5 50 0 0 1 3 H50 0 6.8670626 2.0599999 0 49 5 51 0 0 1 3 H51 0 5.4641018 1.63 0 50 5 52 0 0 1 3 H52 0 4.1995482 1.2750524 0 51 5 53 0 0 1 3 H53 0 4.9966044 1.2750524 0 52 5 54 0 0 1 3 H54 0 4.2689867 3.5599999 0 53 5 55 0 0 1 3 H55 0 2.8660254 4.3699999 0 54 5 56 0 0 1 3 H56 0 1.4630642 3.5599999 0 55 5 57 0 0 1 3 H57 0 1.4630642 1.9399999 0 56 5 58 0 0 1 3 H58 0 2.8660254 1.13 0 57 5 59 0 0 1 3 H59 0 6.8670626 3.4400001 0 58 5 60 0 0 1 3 H60 0 6.1180749 5.3326092 0 59 5 61 0 0 1 3 H61 0 5.7195463 4.6423383 0 60 5 62 0 0 1 3 H62 0 7.4082046 4.6673908 0 61 5 63 0 0 1 3 H63 0 7.8067331 5.3576617 0 62 5 64 0 0 1 3 H64 0 6.9840999 6.8326097 0 63 5 65 0 0 1 3 H65 0 6.5855713 6.1423383 0 64 5 66 0 0 1 3 H66 0 8.5296755 5.7750525 0 65 5 67 0 0 1 3 H67 0 9.3267317 5.7750525 0 66 5 68 0 0 1 3 H68 0 10.006281 6.1673908 0 67 5 69 0 0 1 3 H69 0 10.404809 6.8576617 0 68 5 70 0 0 1 3 H70 0 9.3267317 8.7249479 0 69 5 71 0 0 1 3 H71 0 8.5296755 8.7249479 0 70 5 72 0 0 1 3 H72 0 7.8501253 8.3326092 0 71 5 73 0 0 1 3 H73 0 7.4515967 7.6423383 0 72 5 74 0 0 1 3 H74 0 5.7931914 -0.94000006 0 73 5 75 0 0 1 3 H75 0 5.7931914 -2.5599999 0 74 5 76 0 0 1 3 H76 0 9.4651394 -5.4400001 0 75 5 77 0 0 1 3 H77 0 9.4651394 -7.0599999 0 76 0 1 0 0 0 1 11 1 2 78 0 0 1 0 0 0 1 0 0 1 2 11 79 0 0 21 0 1 1 1 2 3 11 80 0 0 20 0 1 1 2 3 4 11 81 0 0 21 0 1 1 3 4 5 11 82 0 0 1 0 1 0 4 5 6 11 83 0 0 1 0 1 0 5 6 7 11 84 0 0 1 0 1 0 6 7 8 11 85 0 0 21 0 1 1 7 8 9 11 86 0 0 20 0 1 1 8 9 10 11 87 0 0 21 0 1 1 9 10 11 11 88 0 0 1 0 1 0 10 11 12 11 89 0 0 1 0 1 0 11 12 13 11 90 0 0 2 0 1 0 12 12 14 11 91 0 0 1 0 1 0 13 14 15 11 92 0 0 1 0 1 0 14 15 16 11 93 0 0 1 0 1 0 15 16 17 11 94 0 0 1 0 1 0 16 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FC(F)(F)C1=CC=C(COC2=CC=C(NC(=O)NC(CC3=CC=CC=C3)C(=O)NCCCN4CCOCC4)C=C2)C=C1u}M6ƱZqۇ+e_Z{{}G{j9l;ܵMuMrz½90ƿVjӣݷG Ϸw7^OSA$0e4e8f75-82ad-46eb-b026-40eb9f42e85077 F1 4.73205097.750C2 3.73205097.750 F3 3.73205098.750 F4 2.73205097.750C5 3.73205096.750C6 2.866025456.250C7 2.866025455.250C8 3.73205094.750C9 3.73205093.750 O10 4.598076343.250 C11 4.598076342.250 C12 3.73205091.750 C13 3.73205090.750 C14 4.598076340.250N15 4.59807634-0.750C16 5.46410179-1.250O17 6.33012724-0.750N18 5.46410179-2.250C19 6.33012724-2.750C20 7.19615221-2.250C21 8.06217766-2.750C22 8.06217766-3.750C23 8.92820358-4.250C24 9.79422855-3.750C25 9.79422855-2.750C26 8.92820358-2.250C27 6.33012724-3.750O28 7.19615221-4.250N29 5.46410179-4.250C30 5.46410179-5.250C31 4.59807634-5.750C32 4.59807634-6.750 N33 3.7320509-7.250!C34 3.7320509-8.250"C35 2.86602545-8.750#O362-8.250$C372-7.250%C38 2.86602545-6.750&C39 5.464101790.750'C40 5.464101791.750(C41 4.598076345.250)C42 4.598076346.250*H43 2.32908964 6.559999940+H44 2.32908964 4.940000060,H45 3.12146997 3.857661960-H46 3.51999831 3.167390580.H47 3.19511509 2.059999940/H48 3.19511509 0.43999999800H49 4.06114054 -1.0599999401H50 4.92716599 -2.5599999402H51 5.79319143 -3.0599999403H52 7.59468031 -1.7750524304H53 6.79762363 -1.7750525505H54 7.52524185 -4.0599999406H55 8.92820358 -4.8699998907H56 10.3311644 -4.0599999408H57 10.3311644 -2.4400000609H58 8.92820358-1.630:H59 4.92716599 -3.940000060;H60 5.67615414 -5.832609650<H61 6.07468271 -5.142338280=H624.386024 -5.167390350>H63 3.98749542 -5.857661720?H64 4.81012869 -7.332609650@H65 5.20865726 -6.642338280AH66 3.94410348 -8.832609180BH67 4.34263182 -8.14233780CH68 2.46749711 -9.224947930DH69 3.26455379 -9.224947930EH70 1.78794765 -6.667390350FH71 1.3894192 -7.357661720GH72 3.26455379 -6.275052550HH73 2.46749711 -6.275052550IH74 6.0010376 0.4399999980JH75 6.0010376 2.059999940KH76 5.13501215 4.940000060LH77 5.13501215 6.55999994080            !!!"""###$$$%% %& &'&'( ')(*()+),*-+.,/-0 .1 /2031425364758697:8;9<:=;><?=@>A?B@C!AD!BE"CF"DG$EH$FI%GJ%HK&IL'JM(KN)LO0H00000000-0000-0000-0000-000000000000Rk nrRGBlus##ǜLb{` 50099639*jL)>VzQuinoline?8aCnCJF@]/ ?33@%Kt7& vCC(C)NC(=O)C1=C2C=CC=CC2=NC(=C1CN3CCN(CC3)C(C)C)C4=CC=CC=C4/Rյ 1WwC"urBiO; ic zrDscbz:734b ^Jˤɛլ7޸wp<%!G,i?FZtʶ4KboX}OSA$bbc29b82-0a78-4f0b-9bd6-81b54c0f010966C1 7.2879591 -2.748064760C2 8.15398407 -2.248064760C3 9.02000999 -2.748064760N4 8.15398407 -1.248064760C5 7.2879591 -0.7480648160O6 6.42193365 -1.248064760C7 7.2879591 0.2519351840C8 8.15398407 0.7519351840C9 9.04792595 0.2172739210 C10 9.95399284 0.7311197520 C11 9.95399284 1.772750620 C12 9.04792595 2.286596540 C13 8.15398407 1.751935240 N14 7.2879591 2.251935240C15 6.42193365 1.751935240C16 6.42193365 0.7519351840C17 5.5559082 0.2519351840N18 4.91319704 -0.5141735080C19 3.92832541 -0.3404954670C20 3.28555679 -1.106558560N21 3.62762189 -2.04626250C22 4.61235332 -2.219846250C23 5.25514078 -1.453801870C24 2.98483443 -2.812306880C25 3.32677794 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-2.880000110CH68 1.46306419 -3.690000060DH69 1.46306419 -5.309999940EH70 2.86602545 -6.119999890FH71 4.2689867 -5.30999994074          ! " !#!"$"#%#$&$'%(&)'*(+),*-+. ,/ -0 .1/2031425364758697:8;9<:=;><?=@>A?B@CAD BE!CF"DG#EH$FI0H00000000-0000-0000-0000-000000000000CardViewStateskGG<Custom>@`@f@^@1MS Shell Dlg 22@1@^@VMS Shell Dlg 22@Z@@^@1MS Shell Dlg 22Compound ID@^@^@1MS Shell Dlg 22NK2 pKi@a`@^@1MS Shell Dlg 22logS@^@1MS Shell Dlg 22@1@^@PMS Shell Dlg 22@U4@^@Q@MS Shell Dlg 22@`@f@\@1333333MS Shell Dlg 22n of N (--%)@1333333@\@aٙMS Shell Dlg 22SingletonsUb4_i@K7!2@8aD @%A.@hwnjYlWuOz% WT6R@K.ƒdVrI }cW@~@(!EfDnAl!}I@~@^o*Gr!R@,r|@DQ x@r@u%O;1@r@Q(N@ރFӒzkR@516m@,BXR^@r@X[rgJ`C9*sR@𦅀OL-+"XVR@1_Gz۝\R@(<ОO0|X@r@X;HMS Fi*R@jYO[SHRS_@~@؞a0Kf<&R@J"3njMT/6@\@@"XCdR@ L,Nιplq{q@r@O2^[N'á@~@d. MrJ9D`@\@@Fdn̡OpLӮM4@\@@Ym\HȒ*ɩ!@\@@(<{S@F@r@(9wG7S`R@"E?BSC?ݘ@\@@U&>L$@@\@@jң|?/@aVaPܳ@\@@53ӵF!2tN'@\@@Tu@ʀP:+DR@v.OLӲw"BR@yPpJDOrU `L@~@JʊCo_uW;@~@e{pUĤ@RnozV@~@ IZGUsꨂ@~@ B+Jm܄ }@~@4?7E88@\@@vKݩ6@r@d3Jƅ[]FXE@*~AF`@"  MCS Cluster = 10@F˨E4kE̠9=&@)c@"!B- R@@Ô>Ev~Qȟ@~@rGU.Hoyl@~@R]03Lܣ]G@~@oI[,[|R@Б@PC3@\@@ʀzA%\И-@\@@U@hDE dR@ϺGW#J)H^] R@ʀ>SJxsd@\@@ BՠFŋEz]@r@ʀTCoC6P:vD@\@@Б@Kl4ބ'x@\@@с@DF0DL.g@r@ϺbpMK`1ҽFΡV@r@2ǙMTK/(HR@с@թLҿjbDp@~@@FyxJyb@~@ʀ`bwDd(R@ȲIsY/N@r@U@|8_vNRrC@~@Bb$G>H@\@@@I%]@)c@"! MCS Cluster = 11@ @x߃ L@.{5i@)F*P@"@ƮbC)W?C`h+SJ6@r@@qO؈3cʡVR@rts|,IV:n @)F*P@"@Ʈb MCS Cluster = 12@bŁ` @LWH7 @(JT`@!) G!\:@r@ѽ@q+L=9K|@\@@E@ulK?QrO,@\@@@F@ i@\@@ @Ь$JC@r@с@8TUNǩ˿@~@ @RL['QWt@r@@J>aAE&ݘIP@~@с@[rBW'@\@@ϺfLa_@(JT`@! MCS Cluster = 13@`@@Z%A6 u{p@"lf-@`CMMƹ_;h@r@ @7Hj؝@"lf-@` MCS Cluster = 14@W"(@o(``!b$Bkmk-{?<4i}{HºUjk-{?<4 MCS Cluster = 15@}@Q`n@F݊h@&NNN^@ (2uGغaBUO@\@@Rk nrRGBlus#@~@U@G'GHdF@r@RE,㷻۩R@R،<wC|g3{Oi@&NNN^@ (2 MCS Cluster = 16@|@| ,ԠA_:)@&7:$@@ S%a]Cn7,J8R@˂8SH@T@\@@O]ge@Y%pbhR@JY.ʋE>@r@YiAr@@~@JC4N@~@ DB*P@~@ڀ8wAFì~5`tDe@&7:$@@ S MCS Cluster = 17@z5@nհᦌ/ Htu2>wW@#G#@@{g%r_Dm\Ɛѧ@#G#@@{g MCS Cluster = 18@@FpA+V.p@)29[@!\$X@-v@\@@JC~3M4o_`@)29[@!\ MCS Cluster = 19@td@p+`6M/sHkb@;2`@@twBVw3{U@\@@E]J?L8@r@€4.+M'Q0lª@\@@ڀCJgF%,g7@;2`@@tMCS Cluster = 2@E@S*ȰmhH˸6 O@'`@ HMPHo~qLU @\@@p8m/D֑$}@r@ %~MA%[R@%@@r@ڀL }G{uJb@~@b+Kh)Z@\@@zk?E0@r@eGGNX%E@@r@ =UJ\NL@r@dK3.3R@Um+HKQGoR@JJ rN >3@@~@5𒏙OaoIR@+MF2Ib@r@E+|:OF"N@r@iS N*@~@yPUg[GZ^~@\@@2*oLGvNAJ$VR@7dO;uJ@\@@d5`HD$@r@JJ+{@'`@ HM MCS Cluster = 20@ƚ @J 9K%Gtx*@(z"G@!wW@4#`u@~@ Kyo\Ƅ@\@@%I&OɝMJOR@ KMMᝨ?yR@:RMT @\@@l[^CzTVr@~@ϺΰzaK VR@6?CS\%i@(z"G@!wW MCS Cluster = 21@|l`@_n>AỆ D@֭z3@AL?xO?3`S@֭z3@AL MCS Cluster = 22@%@TqdNɀϣ41@&Mm8@ lݞlOJnӆ8@&Mm8@ MCS Cluster = 3@0`@qr?Jͥn9S@)حv@" ;[֊Om- @~@bq+yKS~@\@@*/cWn?Jޖ' ^@~@p5GV(@r@MۨMmyRg@\@@yP!ML6@r@bB/@r@JaC{J!qNR@EbDIRqR@ɢ&I]T@r@5&uCQVz@~@gO3N쮚)@r@-!B? |DQ@~@€LsLMFr R@dQ?NT,GX$f@~@{eEĬ[>B@)حv@" ;MCS Cluster = 4@@o`JOhQz*}a@'ĉV@@   * gKK&1%@~@Pv.rBD @~@裍JXσ @r@%(0Oεt@~@UZEH¼@r@j+~M%Z4@\@@ZPV2&GdF @r@}2H VR@:q㌑4N@\x@~@C]΍OjzV%0@\@@ʒLL2FXVn@\@@BOu5L]LR@2!G $U@r@˂¹ MʢIr@~@j,!pqGӅ=5@r@ÊPB@# R@zQC0dFaJI@~@jڥF-$~.R@ڀ~DS-qe﴿@~@J&d7IVм]!k@'ĉV@@  MCS Cluster = 5@4y@y`>/H"FKپ^qg{@*gHp[@"?ȝ5jhKe5v,@\@@zw a`HjC@\@@CLe2{@\@@>âQ1Hf嶉(Z@r@928Mb<%D@\@@jO@r@")Hٟ}}V#@~@z' ANhX)@~@2'8AGXh4UR@š96KJ^/@r@b鉚HI6nZos@r@šjiS]tF6_R@"A`OoHXo@r@BxI EN7M@\@@N>v@􆨣0<;@\@@މRHV]ް@\@@{Gf|WrR@ Gƒw@r@:7tB UcwR@y1OUF/<^@r@֬Ep&Qg@r@Mw@Iڣ^+;R@AcAO̚MD`ި@~@˂uMksǒҵ@\@@ɢRI Oo @~@š1G.ěHot0@\@@gx{Db\&^@~@ʒs$,H]IЭ~vR@B>N!J](@\@@V@2kN9&<+=@\@@€A3./r9JVX|@~@%@Lq6u&R@Ê+KO#Pf@*gHp[@"?ȝMCS Cluster = 6@o@q4@ȵ0WBe< vqW@)I8@@!z6KhOwWCCS0\l@\@@2&"#LL'L{@r@Ō_Fܫ'C @\@@r•cI5;^u("@\@@ 1>xN ?/@\@@škv,BߌW9C@r@EJAa@r&d&?@r@*Ȝ? Ngm여R@O-``H)!yb@r@r X@O@~@FAOT6@r@EG9'G93@~@Ê|YEĺI@~@"!N?GW@R@baIN]x'@\@@B\ՋME )@~@a,Nyz@\@@ÊyRL_M`-NR@ J@ @r@6*C}pq,@)I8@@!z6MCS Cluster = 7@?q@0*5A6Hz@*)b@"^9̽~-y9<=@$:žR@daH"(#R@Z2El-y@*)b@"^9̽~MCS Cluster = 8@TS`@xeoB5.F\R@*gi@"+g2KA`vO@~@Ȳ 8zGޜ @\@@R C3\K7҂s1@r@ɢާtbqPEB@`@f@^@1MS Shell Dlg 22@1@^@VMS Shell Dlg 22@Z@@^@1MS Shell Dlg 22Compound ID@^@^@1MS Shell Dlg 22NK2 pKi@a`@^@1MS Shell Dlg 22logS@^@1MS Shell Dlg 22@1@^@PMS Shell Dlg 22@U4@^@Q@MS Shell Dlg 22@`@f@\@1333333MS Shell Dlg 22n of N (--%)@1333333@\@aٙMS Shell Dlg 22SingletonssNn’@z58jYlWuOz% WT6@'!@!_\J3 ,F$@%YH&IN^@'!@!_MCS Cluster = 1@@g- ܽ (K#ӽlh@)vR=@@"(u@ݖz2߽@ 3@{I HC㍽"+@ @_EM(@ @juBm<B̃mCV7@ 3@vD.&KJğ~$@/g@juBm90"5[A*︎咴@ 3@juBmGʛL\xOy@_ @{I >dVrI }cW@/ 3@!EfDnAl!}I@O @^o*Gr!@ 3@juBm,r|@DQ x@ 3@{I %O;1@ 3@Q(N@ރFӒzk@/ 3@juBm16m@,BXR^@ @$X[rgJ`C9*s@/ 3@$𦅀OL-+"XV@ 3@juBm1_Gz۝\@~/g@juBm<ОO0|X@dž @X;HMS Fi*@}|0_D@juBmYO[SHRS_@q0_D@{I ؞a0Kf<&@ 3@$"3njMT/6@/ @$"XCd@ @ L,Nιplq{q@? @{I O2^[N'á@}|0_D@{I . MrJ9D`@_ @juBmFdn̡OpLӮM4@_ @$Ym\HȒ*ɩ!@ 3@$<{S@F@/ @9wG7S`@ 3@juBm"E?BSC?ݘ@ @&>L$@@dž @$ң|?/@aVaPܳ@ 3@{I 3ӵF!2tN'@ 3@$u@ʀP:+D@O @{I v.OLӲw"B@ @$pJDOrU `L@? @$ʊCo_uW;@q0_D@juBm{pUĤ@RnozV@ 3@$IZGUsꨂ@ 3@juBm B+Jm܄ }@? @4?7E88@׆ @$vKݩ6@ @{I 3Jƅ[]FXE@)vR=@" MCS Cluster = 10@p@X!@x߃ L@.{5i@){QS2ʀ@"/\@C)W?C`h+SJ6@ @RjuBmqO؈3cʡV@? @RjuBmts|,IV:n @){QS2ʀ@"/\ MCS Cluster = 11@,@@ؠ @LWH7 @"IkFW@?n) G!\:@ @juBmulK?QrO,@ 3@juBmЬ$JC@ 3@juBm8TUNǩ˿@O @juBmRL['QWt@dž @juBmJ>aAE&ݘIP@ @juBm[rBW'@ @juBmfLa_@"IkFW@?n MCS Cluster = 12@|`@ A6 u{p@!`H(`@BOjCMMƹ_;h@ @juBm7Hj؝@!`H(`@BOj MCS Cluster = 13@W'@@q+L=9K|]㤀tڠF@ i]㤀tڤ MCS Cluster = 14@`n@F݊h@!K(3@ZouGغaBUO@׆ @RjuBmRk nrRGBlus#@ @RjuBmG'GHdF@_ @RjuBmE,㷻۩@ 3@RjuBm،<wC|g3{Oi@!K(3@Zo MCS Cluster = 15@p@}|0 ,ԠA_:)@(H@!xWJ}%a]Cn7,J8@ @RjuBm8SH@T@ @RjuBmO]ge@Y%pbh@ 3@5:!6Y.ʋE>@ @5:!6YiAr@@dž @5:!6JC4N@O @5:!6DB*P@/g@5:!68wAFì~5`tDe@(H@!xWJ} MCS Cluster = 16@t@6.@FpA+V.p@eE @)⤔$X@-v@ 3@RjuBmC~3M4o_`@eE @)⤔ MCS Cluster = 17@u@3 9K%Gtx*@*oR9@"(-@4#`u@ 3@5:!6 Kyo\Ƅ@ 3@5:!6I&OɝMJO@~/g@5:!6 KMMᝨ?y@ 3@5:!6:RMT @q0_D@5:!6l[^CzTVr@׆ @5:!6ΰzaK V@? @5:!66?CS\%i@*oR9@"(-MCS Cluster = 2@N @j*ȰmhH˸6 O@*_@"4PHo~qLU @}|0_D@$p8m/D֑$}@}|0_D@juBm %~MA%[@~/g@{I @@ @{I L }G{uJb@/ @juBmb+Kh)Z@ @$zk?E0@O @$GGNX%E@@q0_D@ =UJ\NL@ @{I dK3.3@ @m+HKQGo@ @{I J rN >3@@/g@𒏙OaoI@ 3@+MF2Ib@O @juBm+|:OF"N@/g@juBmiS N*@ @juBmUg[GZ^~@ 3@juBm2*oLGvNAJ$V@/ 3@{I 7dO;uJ@׆ @{I 5`HD$@ 3@{I J+{@*_@"4MCS Cluster = 3@0;`@^r?Jͥn9S@*_d@"[֊Om- @/ @5:!6q+yKS~@q0_D@i5:!7/cWn?Jޖ' ^@ @5:!6p5GV(@ @5:!6MۨMmyRg@}|0_D@i5:!7!ML6@/g@i5:!7bB/@/ 3@i5:!7aC{J!qN@~/g@i5:!7bDIRq@ 3@i5:!7&I]T@ 3@i5:!7&uCQVz@ 3@i5:!7gO3N쮚)@ 3@i5:!7-!B? |DQ@ 3@i5:!7LsLMFr @ @i5:!7Q?NT,GX$f@׆ @i5:!7{eEĬ[>B@*_d@"MCS Cluster = 4@Ϯ`@d@JOhQz*}a@)]Tj@"4kk * gKK&1%@dž @i5:!7Pv.rBD @? @i5:!7裍JXσ @ @i5:!7(0Oεt@/ @i5:!7ZEH¼@ @i5:!7+~M%Z4@ @i5:!7PV2&GdF @q0_D@I5:!7}2H V@}|0_D@I5:!7q㌑4N@\x@/g@I5:!7C]΍OjzV%0@~/g@I5:!7LL2FXVn@/ 3@I5:!7Ou5L]L@ 3@I5:!7!G $U@ 3@I5:!7¹ MʢIr@ 3@I5:!7,!pqGӅ=5@ 3@I5:!7PB@# @ 3@I5:!7QC0dFaJI@ @I5:!7ڥF-$~.@_ @I5:!7~DS-qe﴿@׆ @I5:!7&d7IVм]!k@)]Tj@"4kkMCS Cluster = 5@]h@rǀ>/H"FKپ^qg{@*6k @"W.Q5jhKe5v,@~/g@5:!7w a`HjC@q0_D@5:!7CLe2{@/ @)5:!7>âQ1Hf嶉(Z@ @I5:!7928Mb<%D@~/g@ 5:!7O@ @ 5:!7")Hٟ}}V#@ @5:!7' ANhX)@ @I5:!7'8AGXh4U@ 3@)5:!796KJ^/@O @ 5:!7鉚HI6nZos@~/g@5:!7jiS]tF6_@_ @5:!7A`OoHXo@/g@5:!7xI EN7M@O @5:!7N>v@􆨣0<;@O @)5:!7މRHV]ް@/ 3@5:!7{Gf|Wr@/ @5:!7 Gƒw@ 3@5:!77tB Ucw@ 3@ 5:!7y1OUF/<^@ @5:!7֬Ep&Qg@_ @)5:!7Mw@Iڣ^+;@ @5:!7AcAO̚MD`ި@ 3@5:!7uMksǒҵ@ @ 5:!7RI Oo @/g@)5:!71G.ěHot0@/ 3@)5:!7gx{Db\&^@׆ @5:!7s$,H]IЭ~v@? @5:!7>N!J](@q0_D@)5:!7V@2kN9&<+=@ @5:!7A3./r9JVX|@/ 3@5:!7@Lq6u&@ @)5:!7+KO#Pf@*6k @"W.QMCS Cluster = 6?>D @kȵ0WBe< vqW@)JC @":IIUKhOwWCCS0\l@ 3@)5:!7&"#LL'L{@/ @I5:!7Ō_Fܫ'C @ 3@5:!7•cI5;^u("@ @)5:!7 1>xN ?/@ 3@ 5:!7kv,BߌW9C@q0_D@ 5:!7EJAa@r&d&?@ 3@5:!7Ȝ? Ngm여@/g@5:!7O-``H)!yb@ 3@5:!7 X@O@dž @5:!7FAOT6@ @5:!7EG9'G93@? @I5:!7|YEĺI@ @5:!7!N?GW@@ 3@)5:!7aIN]x'@/ 3@ 5:!7\ՋME )@ @ 5:!7a,Nyz@׆ @ 5:!7yRL_M`-N@ @ 5:!7 J@ @? @)5:!76*C}pq,@)JC @":IIUMCS Cluster = 7@u*5A6Hz@!cc@~f-y9<=@$:ž@}|0_D@5:!7daH"(#@ @5:!72El-y@!cc@~fMCS Cluster = 8@[$`@j@oB5.F\R@(J@!'s+g2KA`vO@ 3@5:!7 8zGޜ @ 3@5:!7 C3\K7҂s1@ @I5:!7ާtbqPEBEv~Qȟ@/ @juBmGU.Hoyl@ 3@juBm]03Lܣ]G@ 3@juBmoI[,[|@O @juBmPC3@/ 3@juBmzA%\И-@ @juBmhDE d@ @juBmGW#J)H^] @q0_D@juBm>SJxsd@ 3@juBmBՠFŋEz]@_ @juBmTCoC6P:vD@/ 3@RjuBmKl4ބ'x@_ @juBmDF0DL.g@ 3@juBmbpMK`1ҽFΡV@}|0_D@juBmǙMTK/(H@ @juBmթLҿjbDp@/g@RjuBmFyxJyb@/ @juBm`bwDd(@ 3@juBmIsY/N@? @juBm|8_vNRrC@? @juBmb$G>H@/g@juBmI%]@*$ G@"e,Du@JMCS Clustering - 14-Oct-2014 15:48:15?$Y9~pP22 serialization::archive 11 0 1 1 27 CVChemicalSpaceLayoutEngine 1 0 0 0 0 1.60000000000000000e+001 1.80000000000000000e+002 -1.00000000000000000e+000 -1.00000000000000000e+000 1.00000000000000000e+000 1 0GG<Custom>@`@f@^@1MS Shell Dlg 22@1@^@VMS Shell Dlg 22@Z@@^@1MS Shell Dlg 22Compound ID@^@^@1MS Shell Dlg 22NK2 pKi@a`@^@1MS Shell Dlg 22logS@^@1MS Shell Dlg 22@1@^@PMS Shell Dlg 22@U4@^@Q@MS Shell Dlg 22@`@f@\@1333333MS Shell Dlg 22n of N (--%)@1333333@\@aٙMS Shell Dlg 22Singletons@t{~‡P@r* jYlWuOz% WT6@*AsR@"u΀>N!J](@@n2@Wem&*5A6Hz@H#F @Wem&$X@-v@#F @nM`\J3 ,F$@%8TUNǩ˿@#F @M`_PEITUFr@#F @em&YH&IN^s {I#@%A3./r9JVX|@*AsR@"u΀MCS Cluster = 1@~R- ܽ (K#ӽlh@< @@ f(u@ݖz2߽@F7|@s+o15HC㍽"+@#F @ݕ_EM(@#F @.M`<B̃mCV7@F7|@ݕvD.&KJğ~$@`n2@M`90"5[A*︎咴@F7|@.M`GʛL\xOy@#F @s+o15>dVrI }cW@F7|@ݕ!EfDnAl!}I@#F @ݕ^o*Gr!@F7|@.M`,r|@DQ x@F7|@s+o15%O;1@F7|@ݕQ(N@ރFӒzk@F7|@.M`16m@,BXR^@#F @]X[rgJ`C9*s@F7|@]𦅀OL-+"XV@F7|@.M`1_Gz۝\@@n2@.M`<ОO0|X@8#F @ݕX;HMS Fi*@n2@.M`YO[SHRS_@uA4d@s+o15؞a0Kf<&@F7|@]"3njMT/6@#F @]"XCd@(#F @ݕ L,Nιplq{q@#F @s+o15O2^[N'á@n2@s+o15. MrJ9D`@#F @.M`Fdn̡OpLӮM4@#F @]Ym\HȒ*ɩ!@F7|@]<{S@F@#F @ݕ9wG7S`@F7|@.M`"E?BSC?ݘ@#F @ݕ&>L$@@8#F @]ң|?/@aVaPܳ@F7|@s+o153ӵF!2tN'@F7|@]u@ʀP:+D@#F @s+o15v.OLӲw"B@(#F @]pJDOrU `L@#F @]ʊCo_uW;@uA4d@.M`{pUĤ@RnozV@F7|@]IZGUsꨂ@F7|@M` B+Jm܄ }@#F @ݕ4?7E88@H#F @]vKݩ6@(#F @s+o153Jƅ[]FXE@< @ f MCS Cluster = 10@@p@LWH7 @)@"n ) G!\:@X#F @M`ulK?QrO,@F7|@M`Ь$JC@F7|@M`RL['QWt@8#F @M`J>aAE&ݘIP@#F @M`[rBW'@X#F @M`fLa_@)@"n  MCS Cluster = 11@2 @c`A6 u{p@ XG @fiCMMƹ_;h@#F @M`7Hj؝@ XG @fi MCS Cluster = 12@h; @*C@q+L=9K|L=PdF@ iL=Pd MCS Cluster = 13@9w`@PHp8m/D֑$}@( @!%c?%+Ng%@@n2@M`m+HKQGo@#F @s+o15L }G{uJb@#F @.M`oF@ɵ(@F7|@]2*oL{@@n2@ݕdK3.3@X#F @ݕN}D[r#4@(#F @.M`Y D㷢CrO9p@{@F7|@em&4 8JƣY @F7|@7em&A`OoHXo@F7|@em&5jhKe5v,@F7|@em&zKib_G8+@F7|@em&O@#F @7em&{Avd%m @#F @7em&ƛPQG@ػ@#F @Wem&uMksǒҵ@#F @7em&xI EN7M@(#F @em&'8AGXh4U@F7|@Wem&C MCS Cluster = 17@`p.@6jiS]tF6_@(1uZ@!v@􆨣0<;@(#F @Wem&' ANhX)@n2@Wem&?'COz0@F7|@Wem&2H(;WP#@#F @Wem&MDLj[wV@H#F @em&)fJ@vieB@(1uZ@!@X#F @.M`JC4N@#F @.M`:RMT @uA4d@.M`l[^CzTVr@H#F @.M`8wAFì~5`tDe@'jn@ ~MCS Cluster = 3@x@@pJOhQz*}a@(}bQf@!iL * gKK&1%@#F @.M`Pv.rBD @#F @.M`裍JXσ @#F @.M`(0Oεt@uA4d@wem&ZEH¼@n2@wem&+~M%Z4@`n2@wem&PV2&GdF @@n2@wem&}2H V@F7|@wem&q㌑4N@\x@F7|@wem&C]΍OjzV%0@F7|@wem&LL2FXVn@F7|@wem&Ou5L]L@F7|@wem&!G $U@F7|@wem&¹ MʢIr@X#F @wem&,!pqGӅ=5@#F @wem&PB@# @H#F @wem&QC0dFaJI@#F @wem&ڥF-$~.@8#F @wem&~DS-qe﴿@#F @wem&&d7IVм]!k@(}bQf@!iLMCS Cluster = 4@{u-@@[D >GvNAJ$V@)@"+3 J rN >3@@`n2@ݕPHo~qLU @n2@]GGNX%E@@uA4d@ݕ+MF2Ib@#F @.M`EAJa-HeY@F7|@ݕo}@T*w(p_@H#F @ݕ+|:OF"N@`n2@.M`Fo+DdI%@8#F @.M` %~MA%[@)@"+3 MCS Cluster = 5@dc@. #BgxwAm>w@* Ѧ@"ۀw a`HjC@@n2@em&Nj0'CQ,:H7@F7|@em&K@̀e6U@#F @wem&/H"FKپ^qg{@F7|@Wem&m 0@nIE@H#F @em&鉚HI6nZos@F7|@em&2El-y@F7|@7em&DB*P@`n2@.M`96KJ^/@(#F @7em&sT@ո58@@n2@em&daH"(#@n2@em&k;EL'-Di@(#F @em&`EKZl@F7|@em&+KO#Pf@F7|@em&<`k4G+ZQIO2'@#F @em&@Lq6u&@#F @Wem&7tB Ucw@#F @7em&1G.ěHot0@F7|@Wem&928Mb<%D@F7|@7em&{Gf|Wr@uA4d@em&")Hٟ}}V#@#F @em&gx{Db\&^@#F @em&މRHV]ް@F7|@em&g\GJj:M@#F @Wem&>Le2{@uA4d@7em&RI Oo @F7|@Wem&AcAO̚MD`ި@F7|@em&-y9<=@$:ž@F7|@em& }A %͠TX@H#F @7em& GƒâQ1Hf嶉(Z@#F @wem&xN ?/@X#F @7em&kv,BߌW9C@@n2@7em&EJAa@r&d&?@F7|@em&O-``H)!yb@F7|@em&ާtbqPEBEv~Qȟ@#F @M`GU.Hoyl@F7|@M`]03Lܣ]G@F7|@M`oI[,[|@#F @M`PC3@F7|@M`zA%\И-@(#F @M`hDE d@(#F @M`GW#J)H^] @uA4d@M`>SJxsd@F7|@M`BՠFŋEz]@#F @M`TCoC6P:vD@F7|@nM`Kl4ބ'x@#F @M`DF0DL.g@F7|@M`bpMK`1ҽFΡV@n2@M`ǙMTK/(H@#F @M`թLҿjbDp@`n2@nM`FyxJyb@#F @M``bwDd(@F7|@M`IsY/N@#F @M`|8_vNRrC@#F @M`b$G>H@`n2@M`I%]@)iӀ@!wMCS Cluster = 9@@@x߃ L@.{5i@!e^v:@!֩C)W?C`h+SJ6@H#F @nM`qO؈3cʡV@#F @nM`ts|,IV:n @!e^v:@!֩JMCS Clustering - 14-Oct-2014 15:52:14?͐hvI} 22 serialization::archive 11 0 1 1 27 CVChemicalSpaceLayoutEngine 1 0 0 0 0 1.60000000000000000e+001 1.80000000000000000e+002 -1.00000000000000000e+000 -1.00000000000000000e+000 1.00000000000000000e+000 1 0GG<Custom>@`@f@^@1MS Shell Dlg 22@1@^@VMS Shell Dlg 22@Z@@^@1MS Shell Dlg 22Compound ID@^@^@1MS Shell Dlg 22NK2 pKi@a`@^@1MS Shell Dlg 22logS@^@1MS Shell Dlg 22@1@^@PMS Shell Dlg 22@U4@^@Q@MS Shell Dlg 22@`@f@\@1333333MS Shell Dlg 22n of N (--%)@1333333@\@aٙMS Shell Dlg 22Singletons@f* .T0tjYlWuOz% WT6@'r@@ ?\J3 ,@YH&IN^@'r@@ ?MCS Cluster = 1@ @- ܽ (K#ӽlh@(ߊ"!@!T8(u@ݖz2߽@`HC㍽"+@(_EM(@<B̃mCV7@vD.&KJğ~$@90"5[A*︎咴@GʛL\xOy@>dVrI }cW@!EfDnAl!}I@p^o*Gr!@,r|@DQ x@n%O;1@g@nQ(N@ރFӒzk@w@n16m@,BXR^@@nX[rgJ`C9*s@@n𦅀OL-+"XV@`@n1_Gz۝\@@n<ОO0|X@@nX;HMS Fi*@@nYO[SHRS_@p@n؞a0Kf<&@`@n"3njMT/6@(@n"XCd@@n L,Nιplq{q@@nO2^[N'á@@n. MrJ9D`@@nFdn̡OpLӮM4@@nYm\HȒ*ɩ!@@n<{S@F@p@n9wG7S`@@n"E?BSC?ݘ@~&>L$@@g@~ң|?/@aVaPܳ@w@~3ӵF!2tN'@@~u@ʀP:+D@@~v.OLӲw"B@`@~pJDOrU `L@@~ʊCo_uW;@@~{pUĤ@RnozV@@~IZGUsꨂ@p@~ B+Jm܄ }@`@~4?7E88@(@~vKݩ6@@~3Jƅ[]FXE@(ߊ"!@!T8 MCS Cluster = 10@e@v@ @LWH7 @(+h@!o7) G!\:@@~ulK?QrO,@@~Ь$JC@@~8TUNǩ˿@`RL['QWt@p@~J>aAE&ݘIP@@~[rBW'@fLa_@(+h@!o7 MCS Cluster = 11@`@q@A6 u{p@(?B@@!.*a#CMMƹ_;h@@7Hj؝@(?B@@!.*a# MCS Cluster = 12@ @wQ: q+L=9K| F@ i  MCS Cluster = 13@P`n@F݊h@$*$ @t@uGغaBUO@@Rk nrRGBlus#@@G'GHdF@`@E,㷻۩@@،<wC|g3{Oi@$*$ @t@ MCS Cluster = 14@ocq @c ,ԠA_:)@%2ck$@%a]Cn7,J8@w@@8SH@T@`@@O]ge@Y%pbh@@@Y.ʋE>@@@YiAr@@p@JC4N@@@DB*P@(@8wAFì~5`tDe@%2ck$@ MCS Cluster = 15@6k@3zFpA+V.p@(a[@!X z$X@-v@C~3M4o_`@(a[@!X z MCS Cluster = 16@su@ 9K%Gtx*@#-T-`@[kԒ@4#`u@g@ Kyo\Ƅ@@@I&OɝMJO@w@ KMMᝨ?y@@@:RMT @p@@l[^CzTVr@`@@ΰzaK V@@6?CS\%i@#-T-`@[kԒMCS Cluster = 2@;+@ `*ȰmhH˸6 O@)@!2o`PHo~qLU @@p8m/D֑$}@@ %~MA%[@w@@@@L }G{uJb@`@b+Kh)Z@@zk?E0@g@GGNX%E@@@ =UJ\NL@p@dK3.3@p@m+HKQGo@p@J rN >3@@@𒏙OaoI@p@+MF2Ib@@+|:OF"N@iS N*@@Ug[GZ^~@@2*oLGvNAJ$V@@7dO;uJ@g@@5`HD$@@J+{@)@!2o`MCS Cluster = 3@@yg JOhQz*}a@%:\܀@nѦb * gKK&1%@@@Pv.rBD @@@裍JXσ @@@(0Oεt@@@ZEH¼@@@+~M%Z4@p@@PV2&GdF @@@}2H V@q㌑4N@\x@g@C]΍OjzV%0@w@LL2FXVn@@Ou5L]L@@!G $U@`@¹ MʢIr@@,!pqGӅ=5@@PB@# @@QC0dFaJI@p@ڥF-$~.@`@~DS-qe﴿@(@&d7IVм]!k@%:\܀@nѦbMCS Cluster = 4@W1M@P>/H"FKپ^qg{@*m@"Q=5jhKe5v,@@w a`HjC@@CLe2{@@>âQ1Hf嶉(Z@@928Mb<%D@w@O@@")Hٟ}}V#@@' ANhX)@@'8AGXh4U@g@96KJ^/@@鉚HI6nZos@p@jiS]tF6_@@A`OoHXo@@xI EN7M@N>v@􆨣0<;@@މRHV]ް@@{Gf|Wr@@ Gƒw@@7tB Ucw@y1OUF/<^@@֬Ep&Qg@@Mw@Iڣ^+;@`@AcAO̚MD`ި@`@uMksǒҵ@@RI Oo @p@1G.ěHot0@g@gx{Db\&^@`@s$,H]IЭ~v@(@>N!J](@gV@2kN9&<+=@`@A3./r9JVX|@@Lq6u&@@+KO#Pf@*m@"Q=MCS Cluster = 5@ڪȵ0WBe< vqW@*wQp@"0KhOwWCCS0\l@@&"#LL'L{@@Ō_Fܫ'C @@•cI5;^u("@g@ 1>xN ?/@@kv,BߌW9C@@EJAa@r&d&?@p@Ȝ? Ngm여@p@O-``H)!yb@`@ X@O@@FAOT6@@EG9'G93@@|YEĺI@@!N?GW@@@aIN]x'@\ՋME )@p@a,Nyz@@yRL_M`-N@g@ J@ @w@6*C}pq,@*wQp@"0MCS Cluster = 6@cwa@*5A6Hz@5b&@NT-y9<=@$:ž@(@daH"(#@@2El-y@5b&@NTMCS Cluster = 7@FY@oB5.F\R@kiC@ 2%*#R+g2KA`vO@@ 8zGޜ @@ C3\K7҂s1@ާtbqPEBEv~Qȟ@@GU.Hoyl@@]03Lܣ]G@@oI[,[|@p@PC3@`@zA%\И-@(@hDE d@@GW#J)H^] @@>SJxsd@@BՠFŋEz]@@TCoC6P:vD@@Kl4ބ'x@@DF0DL.g@p@bpMK`1ҽFΡV@@ǙMTK/(H@`թLҿjbDp@g@`FyxJyb@w@``bwDd(@@`IsY/N@@`|8_vNRrC@`@`b$G>H@@`I%]@(F %o@!I# MMCS Cluster = 9@@^x߃ L@.{5i@(@!+̀C)W?C`h+SJ6@p@`qO؈3cʡV@`@`ts|,IV:n @(@!+̀JMCS Clustering - 14-Oct-2014 15:52:41?{Ltx~$0t22 serialization::archive 11 0 1 1 27 CVChemicalSpaceLayoutEngine 1 0 0 0 0 1.60000000000000000e+001 1.80000000000000000e+002 -1.00000000000000000e+000 -1.00000000000000000e+000 1.00000000000000000e+000 1 0GG<Custom>@`@f@^@1MS Shell Dlg 22@1@^@VMS Shell Dlg 22@Z@@^@1MS Shell Dlg 22Compound ID@^@^@1MS Shell Dlg 22NK2 pKi@a`@^@1MS Shell Dlg 22logS@^@1MS Shell Dlg 22@1@^@PMS Shell Dlg 22@U4@^@Q@MS Shell Dlg 22@`@f@\@1333333MS Shell Dlg 22n of N (--%)@1333333@\@aٙMS Shell Dlg 22Singletons@he2zBxjYlWuOz% WT6?ux?%L\J3 ,?ux?%L$Cluster member = 1@xwd@@p(%a]Cn7,J8@)/@"0@fLa_@@|U Y DGvNAJ$V@@>-{Ug[GZ^~@@~-{!N?GW@@@ʽNj0'CQ,:H7@-{&d7IVм]!k@(@-{k;EL'-Di@@ʽdK3.3@@|[* KMMᝨ?y@@|[* %~MA%[@@|[* L,Nιplq{q@@kl?xh=K,AQL @@-{I%]@@?ʽ@@@|[*J+-{YO[SHRS_@@kl?Ô>Ev~Qȟ@@_ʽ𦅀OL-+"XV@0tމRHV]ް@@-{ Kyo\Ƅ@w@|[*u@ʀP:+D@p@kl?Ȝ? Ngm여@w@ʽu 0I<;wq@@~-{iS N*@`@~-{ܜOkzg&:@@ʽulK?QrO,@`@|U Y.ʋE>@@[*CIƈ0ۺ@@>-{@4#`u@g@|[*aIN]x'@p@ʽB- @`@_ʽ<`k4G+ZQIO2'@w@ʽuMksǒҵ@@ʽʊCo_uW;@g@|U RI Oo @`@ʽDB*P@@[*3Jƅ[]FXE@@|U ZEH¼@@>-{(u@ݖz2߽@0tbpMK`1ҽFΡV@@_ʽYm\HȒ*ɩ!@(@kl?o}@T*w(p_@@~-{KhOwWCCS0\l@@ʽ4 8JƣY @g@ʽpJDOrU `L@|U O-``H)!yb@@ʽ¹ MʢIr@`@-{JC4N@@[*7dO;uJ@`@>-{ң|?/@aVaPܳ@@kl?_EM(@0t+g2KA`vO@_ʽ/H"FKپ^qg{@@-{N}D[r#4@@>-{m 0@nIE@@ʽ鉚HI6nZos@(@-{PFײAʤ.IU@@@~-{թLҿjbDp@g@?ʽ!EfDnAl!}I@0tc$h 8Mȍ@p@~-{GGNX%E@@@|[*FyxJyb@w@?ʽ"XCd@@kl?DF0DL.g@p@_ʽ9K%Gtx*@|[*L }G{uJb@@|[*1G.ěHot0@@ʽzKib_G8+@@ʽ' ANhX)@@-{ǙMTK/(H@?ʽiG>{@`@>-{Q(N@ރFӒzk@0tGʛL\xOy@`0t|8_vNRrC@`@?ʽCâQ1Hf嶉(Z@@-{a,Nyz@(@ʽxI EN7M@@-{b+Kh)Z@@|[*5} );OY#m@@~-{YiAr@@@[*{Gf|Wr@@-{ ܽ (K#ӽlh@0t+KO#Pf@@ʽq㌑4N@\x@-{IZGUsꨂ@@|U kv,BߌW9C@ʽ. MrJ9D`@p@kl?>SJxsd@@_ʽhDE d@@_ʽg\GJj:M@@ʽ C3\K7҂s1@w@_ʽFdn̡OpLӮM4@`@kl?l[^CzTVr@@|[*RL['QWt@@|U &>L$@@@kl?v.OLӲw"B@@kl?GW#J)H^] @@_ʽ?'COz0@(@ʽN>v@􆨣0<;@@-{Az;@@ʽ,!pqGӅ=5@@-{(0Oεt@@>-{裍JXσ @@>-{8SH@T@`@[*Ь$JC@(@|U TCoC6P:vD@@_ʽsT@ո58@@ʽ{Avd%m @@ʽOu5L]L@@-{+|:OF"N@@~-{EAJa-HeY@@~-{vD.&KJğ~$@0t-y9<=@$:ž@@ʽO2^[N'á@@kl?FAOT6@`@ʽPC3@`@_ʽ%O;1@0tΰzaK V@@|[* 1>xN ?/@@ʽUosIn=@@~-{Pv.rBD @@>-{C]΍OjzV%0@g@-{𒏙OaoI@w@~-{ }A %͠TX@p@-{֬Ep&Qg@g@ʽJOhQz*}a@(@>-{:RMT @`@|[*Ō_Fܫ'C @@ʽI&OɝMJO@@|[*}2H V@@>-{o'Fvo2F@@ʽ90"5[A*︎咴@p0t>N!J](@p@ʽO@@-{YB Cy;4@w@>-{oB5.F\R@@ʽ7tB Ucw@@ʽ'3EǤ-\@@ʽ`EKZl@@ʽjiS]tF6_@@-{~DS-qe﴿@`@-{,ԠA_:)@@[*oF@ɵ(@p@>-{9wG7S`@@kl?w a`HjC@@-{) G!\:@p@|U J>aAE&ݘIP@@|U GU.Hoyl@@_ʽO]ge@Y%pbh@(@[*[rBW'@@|U 6*C}pq,@@ʽ<{S@F@@kl?zA%\И-@(@_ʽ2H(;WP#@`@ʽ@Lq6u&@@ʽ96KJ^/@`@-{2*oLw@p@ʽ-{EJAa@r&d&?@g@ʽJ rN >3@@g@~-{X[rgJ`C9*s@p0t@LWH7 @@|U 7Hj؝@@|U ]03Lܣ]G@@_ʽ*5A6Hz@@ʽ"E?BSC?ݘ@@kl?gx{Db\&^@@ʽ * gKK&1%@@>-{ B+Jm܄ }@@|U ,r|@DQ x@0ts$,H]IЭ~v@@ʽ3ӵF!2tN'@@kl?ȵ0WBe< vqW@@ʽy1OUF/<^@ʽp8m/D֑$}@(@|[*ȰmhH˸6 O@p@|[*3y+_J墢i[g@`@~-{<ОO0|X@g@kl?'8AGXh4U@p@-{"3njMT/6@`@kl?PB@# @@-{oI[,[|@p@_ʽ X@O@@ʽ㷢CrO9p@{@g@-{%+Ng%@@~-{1_Gz۝\@kl?X;HMS Fi*@w@kl?^o*Gr!@0t+MF2Ib@@~-{A`OoHXo@@-{HC㍽"+@`0tV@2kN9&<+=@`@ʽ9IE8U1Q@ʽ>dVrI }cW@(0tMw@Iڣ^+;@w@ʽBՠFŋEz]@@_ʽA6 u{p@@|U ")Hٟ}}V#@@-{K@̀e6U@p@ʽi_/ A @g@>-{MDLj[wV@`@ʽ|YEĺI@@ʽ6?CS\%i@@|[*daH"(#@@ʽ\ՋME )@`@ʽm+HKQGo@~-{؞a0Kf<&@@kl?928Mb<%D@`@-{IsY/N@@?ʽ_PEITUFr@w@-{4?7E88@`@|U dNoH[?zC@>-{16m@,BXR^@0t•cI5;^u("@p@ʽCMMƹ_;h@p@|U {pUĤ@RnozV@w@|U PHo~qLU @`@|[*QC0dFaJI@@-{ 8zGޜ @g@_ʽKl4ބ'x@@_ʽ)fJ@vieB@@-{ GƒH@@?ʽyRL_M`-N@@ʽڥF-$~.@p@-{<B̃mCV7@0t>Le2{@@-{&"#LL'L{@@ʽާtbqPEB-{8wAFì~5`tDe@@[*2El-y@p@ʽ =UJ\NL@p@|[*A3./r9JVX|@(@ʽ`bwDd(@@?ʽE4kE̠9=&@@_ʽvKݩ6@@|U !G $U@@-{PV2&GdF @)/@"0@$Cluster member = 2@PLL2FXVn@#a.@ݼ7 Wq+L=9K|@[*F@ i@g@[*8TUNǩ˿@#a.@ݼ7 W$Cluster member = 3@P`n@F݊h@)H!B@!ŀʛ=@FpA+V.p@@[*uGغaBUO@@[*Rk nrRGBlus#@@[*G'GHdF@`@[*$X@-v@p@[*C~3M4o_`@@[*x߃ L@.{5i@@?ʽYH&IN^@w0tC)W?C`h+SJ6@p@?ʽqO؈3cʡV@`@?ʽE,㷻۩@@[*ts|,IV:n @(@?ʽ،<wC|g3{Oi@)H!B@!ŀʛ=@BClustering - 14-Oct-2014 15:52:55?$sYjiD :At2zB22 serialization::archive 11 0 1 1 27 CVChemicalSpaceLayoutEngine 1 0 0 0 0 1.60000000000000000e+001 1.80000000000000000e+002 -1.00000000000000000e+000 -1.00000000000000000e+000 1.00000000000000000e+000 1 0GG<Custom>@`@f@^@1MS Shell Dlg 22@1@^@VMS Shell Dlg 22@Z@@^@1MS Shell Dlg 22Compound ID@^@^@1MS Shell Dlg 22NK2 pKi@a`@^@1MS Shell Dlg 22logS@^@1MS Shell Dlg 22@1@^@PMS Shell Dlg 22@U4@^@Q@MS Shell Dlg 22@`@f@\@1333333MS Shell Dlg 22n of N (--%)@1333333@\@aٙMS Shell Dlg 22Singletons@er}BE?;yjYlWuOz% WT6@)h \z@!w6\J3 ,@)h \z@!w6*Cluster member<1> = 1@v @t%a]Cn7,J8@*>\P@"t'Y DGvNAJ$V@p2zBxUg[GZ^~@`2zBx!N?GW@@(2zBxNj0'CQ,:H7@2zBx&d7IVм]!k@2zBxk;EL'-Di@2zBxdK3.3@2zBx KMMᝨ?y@2zBx %~MA%[@2zBx L,Nιplq{q@p2zBxxh=K,AQL @2zBx@@g@kJ+@@kCIƈ0ۺ@@k@4#`u@@kaIN]x'@@k<`k4G+ZQIO2'@@kuMksǒҵ@|X[HʊCo_uW;@g@|X[HRI Oo @w@|X[HDB*P@@|X[H3Jƅ[]FXE@@|X[H(u@ݖz2߽@@|X[HYm\HȒ*ɩ!@@|X[Ho}@T*w(p_@p@|X[HKhOwWCCS0\l@`@|X[H4 8JƣY @(@|X[HpJDOrU `L@@|X[HO-``H)!yb@@|X[H¹ MʢIr@@|X[HJC4N@@|X[H7dO;uJ@@|X[Hң|?/@aVaPܳ@@|X[H_EM(@p@|X[H+g2KA`vO@@|X[H/H"FKپ^qg{@,-N}D[r#4@g@,-m 0@nIE@w@,-鉚HI6nZos@@,-PFײAʤ.IU@@@,-!EfDnAl!}I@@,-c$h 8Mȍ@@,-GGNX%E@@@,-"XCd@`@,-9K%Gtx*@@,-L }G{uJb@@,-1G.ěHot0@@,-' ANhX)@@,-zKib_G8+@@,-iG>{@p@,-Q(N@ރFӒzk@@,-GʛL\xOy@i,-CâQ1Hf嶉(Z@@i,-a,Nyz@@i,-xI EN7M@p@i,-5} );OY#m@(@i,-b+Kh)Z@`@i,-YiAr@@@i,-{Gf|Wr@@i,-+KO#Pf@@i,- ܽ (K#ӽlh@@i,-q㌑4N@\x@@i,-IZGUsꨂ@@i,-kv,BߌW9C@p@i,-. 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L@ ;\J3 ,@W­:lBE?;yYH&IN^@! L@ ;MCS Cluster = 1@ @- ܽ (K#ӽlh@(ckn2@!ZDKm8(u@ݖz2߽W=Rm~@{X~HC㍽"+@*ө(@m$7`_EM(@*ө(@{X~<B̃mCV7@>iԔ @vD.&KJğ~$@URP.@-$7`90"5[A*︎咴W=Rm~@$7`GʛL\xOy@*ө(@[ Hn>dVrI }cW@iԔ @m$7`!EfDnAl!}I@iԔ @{X~^o*Gr!@,*ө(@m$7`,r|@DQ x@*ө(@$7`%O;1@ *ө(@-$7`Q(N@ރFӒzk@ *ө(@[ Hn16m@,BXR^@ *ө(@X[rgJ`C9*s@xURP.@$7`𦅀OL-+"XV@qN[@in1!1_Gz۝\@URP.@m$7`<ОO0|X@iԔ @$7`X;HMS Fi*@xURP.@m$7`YO[SHRS_@W­:l@in1!؞a0Kf<&@}pN[@"3njMT/6W=Rm~@m$7`"XCd@W­:l@[ Hn L,Nιplq{q@>iԔ BE?;yO2^[N'á@,*ө(@-$7`. MrJ9D`@*ө(@۬ HnFdn̡OpLӮM4@*ө(@۬ HnYm\HȒ*ɩ!@W­:l@{X~<{S@F@NiԔ @$7`9wG7S`@*ө(@$7`"E?BSC?ݘ@*ө(@$7`&>L$@@iԔ @۬ Hnң|?/@aVaPܳ@*ө(@{X~3ӵF!2tN'@iԔ @$7`u@ʀP:+D@xURP.@in1!v.OLӲw"B@^iԔ @۬ HnpJDOrU `L@xURP.@{X~ʊCo_uW;@iԔ @in1!{pUĤ@RnozV@*ө(@IZGUsꨂ@xURP.@۬ Hn B+Jm܄ }@*ө(@$7`4?7E88@,*ө(@vKݩ6@,*ө(@v3Jƅ[]FXE@(ckn2@!ZDKm8 MCS Cluster = 10@e@v@ @LWH7 @*e@" ) G!\:@*ө(@vulK?QrO,@*ө(@vЬ$JC@,*ө(@V8TUNǩ˿@iԔ @VRL['QWt@iԔ @vJ>aAE&ݘIP@.iԔ @v[rBW'@*ө(@VfLa_@*e@"  MCS Cluster = 11@`@q@A6 u{p@ CR@Db'CMMƹ_;h@.iԔ @V7Hj؝@ CR@Db' MCS Cluster = 12@ @wQ: q+L=9K|@!+)0@YhF@ i@!+)0@Yh MCS Cluster = 13@P`n@F݊h@"B>@x~uGغaBUOW=Rm~@Rk nrRGBlus#@W­:l@G'GHdF@qN[@E,㷻۩@*ө(@،<wC|g3{Oi@"B>@x~ MCS Cluster = 14@ocq @c ,ԠA_:)@)_3By@!+#R%a]Cn7,J8@qN[BE?;y8SH@T@iԔ @۬ HnO]ge@Y%pbh@^iԔ @$7`Y.ʋE>@*ө(@in1!YiAr@W=Rm~@۬ HnJC4N@ *ө(@{X~DB*P@iԔ @in1!8wAFì~5`tDe@)_3Bx@!+#R MCS Cluster = 15@6k@3zFpA+V.p@|]@VJD8R$X@-v@}pN[@C~3M4o_`@|]@VJD8R MCS Cluster = 16@su@ 9K%Gtx*@%[|n@ }>@4#`u@iԔ @in1! Kyo\Ƅ@URP.@in1!I&OɝMJO@>iԔ @-$7` KMMᝨ?y@NiԔ BE?;y:RMT @NiԔ @-$7`l[^CzTVr@*ө(@۬ HnΰzaK V@*ө(@-$7`6?CS\%i@%[|n@ }>MCS Cluster = 2@;+@ `*ȰmhH˸6 O@)@"2YsrPHo~qLU @*ө(@p8m/D֑$}@NiԔ @$7` %~MA%[@iԔ BE?;y@@.iԔ BE?;yL }G{uJb@}pN[@[ Hnb+Kh)Z@.iԔ @[ Hnzk?E0@iԔ @[ HnGGNX%E@W=Rm~@[ Hn =UJ\NL@}pN[@vdK3.3@iԔ BE?;ym+HKQGo@qN[@J rN >3@@URP.@$7`𒏙OaoI@iԔ @-$7`+MF2Ib@*ө(@m$7`+|:OF"N@qN[@-$7`iS N*@ *ө(@in1!Ug[GZ^~@*ө(BE?;y2*oLiԔ @$7`eO/C%ޕ?@*ө(BE?;yUosIn=@*ө(@-$7`u 0I<;wq@*ө(@in1!Fo+DdI%@URP.BE?;y5} );OY#m@iԔ @[ Hno}@T*w(p_@qN[@{X~EAJa-HeY@}pN[@-$7`c$h 8Mȍ@.iԔ @{X~PFײAʤ.IU@@>iԔ @{X~dNoH[?zC@*ө(@i_/ A @iԔ @m$7`YB Cy;4@}pN[@$7`CIƈ0ۺ@*ө(@in1!>GvNAJ$V@ *ө(BE?;y7dO;uJ@*ө(@{X~5`HD$@qN[@$7`J+{@)@"2Ysr MCS Cluster = 3@@yg JOhQz*}a@)v1H@"G6 * gKK&1%@NiԔ @6Pv.rBD @*ө(@6裍JXσ @>iԔ @۬ Hn(0Oεt@iԔ @6ZEH¼@iԔ @6+~M%Z4@W­:l@vPV2&GdF @*ө(@6}2H V@iԔ @-$7`q㌑4N@\x@URP.@۬ HnC]΍OjzV%0@iԔ @6LL2FXVn@,*ө(@6Ou5L]L@W­:l@-$7`!G $U@xURP.@6¹ MʢIr@*ө(@{X~,!pqGӅ=5@^iԔ @6PB@# @>iԔ @6QC0dFaJI@iԔ @ڥF-$~.@*ө(@6~DS-qe﴿@*ө(@6&d7IVм]!k@)v1H@"G6MCS Cluster = 4@W1M@P>/H"FKپ^qg{@'Qb@!W@455jhKe5v,@xURP.BE?;yw a`HjC@iԔ @$7`CLe2{@iԔ @>âQ1Hf嶉(Z@NiԔ @[ Hn928Mb<%D@URP.@O@qN[@$7`")Hٟ}}V#@iԔ @m$7`' ANhX)@xURP.@[ Hn'8AGXh4U@.iԔ @$7`96KJ^/@iԔ @$7`鉚HI6nZos@iԔ @{X~jiS]tF6_@ *ө(@$7`A`OoHXo@ *ө(@m$7`xI EN7M@>iԔ @[ HnN>v@􆨣0<;@NiԔ @۬ HnމRHV]ް@}pN[@in1!{Gf|Wr@W­:l@۬ Hn GƒiԔ @m$7`ܜOkzg&:@*ө(@in1!m 0@nIE@NiԔ @{X~o'Fvo2F@.iԔ @-$7`K@̀e6U@NiԔ @m$7`2H(;WP#@iԔ @$7`?'COz0@iԔ @۬ HnsT@ո58@.iԔ @۬ Hnk;EL'-Di@^iԔ BE?;yAz;@iԔ @۬ Hn'3EǤ-\@,*ө(@$7`zKib_G8+@,*ө(@[ Hn{Avd%m W=Rm~@-$7`BgxwAm>wW=Rm~@$7`7tB Ucw@xURP.@$7`y1OUF/<^@iԔ @$7`֬Ep&Qg@iԔ @-$7`Mw@Iڣ^+;@^iԔ @m$7`AcAO̚MD`ި@,*ө(BE?;yuMksǒҵ@NiԔ @in1!RI Oo @>iԔ @in1!1G.ěHot0@URP.@[ Hngx{Db\&^@ *ө(@$7`s$,H]IЭ~v@*ө(@$7`>N!J](@W­:l@$7`V@2kN9&<+=@*ө(@m$7`A3./r9JVX|@xURP.@v@Lq6u&@>iԔ @$7`+KO#Pf@'Qb@!W@45MCS Cluster = 5@ڪȵ0WBe< vqW@*B+@"=KhOwWCCS0\l@}pN[@{X~&"#LL'L{@.iԔ @Ō_Fܫ'C @iԔ @-$7`•cI5;^u("@*ө(@ 1>xN ?/@*ө(@-$7`kv,BߌW9C@,*ө(@۬ HnEJAa@r&d&?@}pN[@$7`Ȝ? Ngm여@,*ө(@in1!O-``H)!yb@,*ө(@{X~ X@O@W­:l@m$7`FAOT6@*ө(@-$7`EG9'G93@*ө(@[ Hn|YEĺI@iԔ @m$7`!N?GW@@*ө(BE?;yaIN]x'@^iԔ @in1!\ՋME )@W­:l@a,Nyz@iԔ @[ HnyRL_M`-N@iԔ @ J@ @^iԔ @[ Hn6*C}pq,@*B+@"=MCS Cluster = 6@cwa@*5A6Hz@iǁ@@H)%˄-y9<=@$:ž@xURP.@-$7`daH"(#W=Rm~@2El-y@iǁ@@H)%˄MCS Cluster = 7@FY@oB5.F\R@$lP@1f+g2KA`vO@iԔ @{X~ 8zGޜ @^iԔ @ C3\K7҂s1@*ө(@۬ HnާtbqPEBEv~Qȟ@>iԔ @vGU.Hoyl@*ө(@V]03Lܣ]G@xURP.@VoI[,[|@^iԔ @vPC3@URP.@VzA%\И-@iԔ @VhDE d@iԔ @vGW#J)H^] W=Rm~@V>SJxsd@*ө(@VBՠFŋEz]@*ө(@vTCoC6P:vD@URP.@6Kl4ބ'x@*ө(@VDF0DL.g@ *ө(@vbpMK`1ҽFΡV@W­:l@VǙMTK/(H@iԔ @VթLҿjbDp@qN[@6FyxJyb@>iԔ @V`bwDd(@ *ө(@VIsY/N@NiԔ @v|8_vNRrC@NiԔ @Vb$G>H@qN[@VI%]@* 3@"U2MCS Cluster = 9@@^x߃ L@.{5i@)o@@"JCC)W?C`h+SJ6@*ө(@qO؈3cʡV@ *ө(@ts|,IV:n @)o@"JCJMCS Clustering - 14-Oct-2014 15:54:03?DΨ9DyJ,wUI"22 serialization::archive 11 0 1 1 27 CVChemicalSpaceLayoutEngine 1 0 0 0 0 1.60000000000000000e+001 1.80000000000000000e+002 -1.00000000000000000e+000 -1.00000000000000000e+000 1.00000000000000000e+000 1 0GG<Custom>@`@f@^@1MS Shell Dlg 22@1@^@VMS Shell Dlg 22@Z@@^@1MS Shell Dlg 22Compound ID@^@^@1MS Shell Dlg 22NK2 pKi@a`@^@1MS Shell Dlg 22logS@^@1MS Shell Dlg 22@1@^@PMS Shell Dlg 22@U4@^@Q@MS Shell Dlg 22@`@f@\@1333333MS Shell Dlg 22n of N (--%)@1333333@\@aٙMS Shell Dlg 22SingletonsiS\@\!0xpjYlWuOz% WT6?T?2L\J3 ,?T?2L*Cluster member<2> = 1@w(@uJ%a]Cn7,J8@*dY@"Mܕ9Y DGvNAJ$V@D*@_5xUg[GZ^~@RHtn @sZ!N?GW@@D*@d9\Nj0'CQ,:H7@d*@\d9\&d7IVм]!k@BHtn @sZk;EL'-Di@ $:7 @d9\dK3.3@$:7 @}o KMMᝨ?y@^$FP@9sZ %~MA%[@d*@_5x L,Nιplq{q@$:7 @_5xxh=K,AQL @q$:7 @d9\@@^$FP@v!jJ+@d*@9sZCIƈ0ۺ@d*@}o@4#`u@ !ѸT4@9sZaIN]x'@d*@d9\<`k4G+ZQIO2'@$:7 @d9\uMksǒҵ@$:7 @d9\ʊCo_uW;@d*@s}oRI Oo @^$FP@d9\DB*P@$:7 @ysZ3Jƅ[]FXE@RHtn @_5x(u@ݖz2߽@rHtn @_5xYm\HȒ*ɩ!@bHtn @v!jo}@T*w(p_@$:7 @}oKhOwWCCS0\l@Htn @d9\4 8JƣY @^$FP@d9\pJDOrU `L@q$:7 @v!jO-``H)!yb@Htn @d9\¹ MʢIr@D*@sZJC4N@bHtn @9sZ7dO;uJ@$:7 @_5xң|?/@aVaPܳ@bHtn @_5x_EM(@d*@sZ+g2KA`vO@bHtn @d9\/H"FKپ^qg{@sI!ѸT4@d9\N}D[r#4@^$FP@sZm 0@nIE@BHtn @|d9\鉚HI6nZos@Htn @\d9\PFײAʤ.IU@@D*@v!j!EfDnAl!}I@$:7 @}oc$h 8Mȍ@$:7 @_5xGGNX%E@@ !ѸT4@}o"XCd@a$:7 @}o9K%Gtx*@$:7 @ysZL }G{uJb@sI!ѸT4@sZ1G.ěHot0@ !ѸT4@d9\' ANhX)@$:7 @sZzKib_G8+@sI!ѸT4@d9\iG>{@Htn @}oQ(N@ރFӒzk@rHtn @s}oGʛL\xOy@$:7 @_5xCâQ1Hf嶉(Z@ $:7 @sZa,Nyz@$:7 @d9\xI EN7M@$:7 @|d9\5} );OY#m@d*@v!jb+Kh)Z@^$FP@}oYiAr@@rHtn @9sZ{Gf|Wr@$:7 @d9\+KO#Pf@d*@|d9\ ܽ (K#ӽlh@ $:7 @s}oq㌑4N@\x@a$:7 @9sZIZGUsꨂ@BHtn @sZkv,BߌW9C@a$:7 @d9\. MrJ9D`@$:7 @s}og\GJj:M@bHtn @d9\ C3\K7҂s1@q$:7 @sZFdn̡OpLӮM4@$:7 @v!jl[^CzTVr@Htn @9sZ&>L$@@$:7 @v!jv.OLӲw"B@$:7 @v!j?'COz0@a$:7 @sZN>v@􆨣0<;@$:7 @d9\Az;@$:7 @d9\裍JXσ @$:7 @9sZ8SH@T@$:7 @ysZsT@ո58@^$FP@d9\{Avd%m @$:7 @d9\Ou5L]L@ !ѸT4@sZ+|:OF"N@Htn @s}oEAJa-HeY@bHtn @}ovD.&KJğ~$@Htn @sZ-y9<=@$:ž@a$:7 @d9\O2^[N'á@sI!ѸT4@_5xFAOT6@sI!ѸT4@\d9\%O;1@BHtn @}oΰzaK V@Htn @9sZ 1>xN ?/@Htn @d9\UosIn=@$:7 @_5x𒏙OaoI@rHtn @}o }A %͠TX@bHtn @d9\֬Ep&Qg@RHtn @d9\:RMT @$:7 @ysZŌ_Fܫ'C @Htn @d9\I&OɝMJO@$:7 @ysZ}2H V@$:7 @9sZo'Fvo2F@$:7 @|d9\90"5[A*︎咴@RHtn @s}o>N!J](@$:7 @sZO@RHtn @d9\YB Cy;4@bHtn @s}ooB5.F\R@rHtn @d9\7tB Ucw@rHtn @d9\'3EǤ-\@q$:7 @d9\`EKZl@D*@d9\jiS]tF6_@$:7 @d9\,ԠA_:)@q$:7 @ysZoF@ɵ(@BHtn @v!j9wG7S`@$:7 @s}ow a`HjC@ !ѸT4@\d9\O]ge@Y%pbh@a$:7 @ysZ6*C}pq,@sI!ѸT4@d9\<{S@F@^$FP@s}o2H(;WP#@Htn @d9\@Lq6u&@$:7 @d9\96KJ^/@$:7 @d9\2*oLw@Htn @\d9\3@@D*@}oX[rgJ`C9*s@Htn @v!j*5A6Hz@rHtn @d9\"E?BSC?ݘ@sI!ѸT4@s}ogx{Db\&^@ $:7 @|d9\ B+Jm܄ }@$:7 @}o,r|@DQ x@Htn @_5xs$,H]IЭ~v@a$:7 @|d9\3ӵF!2tN'@RHtn @v!jȵ0WBe< vqW@ $:7 @d9\y1OUF/<^@BHtn @d9\p8m/D֑$}@Htn @sZȰmhH˸6 O@q$:7 @s}o3y+_J墢i[g@rHtn @sZ<ОO0|X@q$:7 @}o'8AGXh4U@d*@d9\"3njMT/6@a$:7 @v!j X@O@$:7 @|d9\㷢CrO9p@{@Htn @|d9\%+Ng%@bHtn @sZ1_Gz۝\@Htn @s}oX;HMS Fi*@D*@s}o^o*Gr!@$:7 @s}o+MF2Ib@$:7 @s}oA`OoHXo@D*@\d9\HC㍽"+@ !ѸT4@s}oV@2kN9&<+=@ !ѸT4@|d9\9IE8U1Q@$:7 @d9\>dVrI }cW@Htn @}oMw@Iڣ^+;@$:7 @|d9\")Hٟ}}V#@$:7 @|d9\K@̀e6U@$:7 @sZi_/ A @ !ѸT4@_5xMDLj[wV@RHtn @d9\|YEĺI@^$FP@|d9\6?CS\%i@D*@9sZdaH"(#@^$FP@\d9\\ՋME )@a$:7 @d9\m+HKQGo@a$:7 @_5x؞a0Kf<&@Htn @v!j928Mb<%D@ !ѸT4@d9\_PEITUFr@$:7 @d9\4?7E88@ $:7 @v!jdNoH[?zC@a$:7 @s}o16m@,BXR^@sI!ѸT4@}o•cI5;^u("@$:7 @d9\{pUĤ@RnozV@rHtn @v!jPHo~qLU @ !ѸT4@v!jQC0dFaJI@rHtn @sZ 8zGޜ @RHtn @|d9\)fJ@vieB@sI!ѸT4@|d9\ GƒLe2{@$:7 @d9\&"#LL'L{@$:7 @sZާtbqPEB = 2@@E4kE̠9=&@&mF@ +ۏB- @$:7 @sZÔ>Ev~Qȟ@ $:7 @sZGU.Hoyl@$:7 @sZ]03Lܣ]G@$:7 @sZoI[,[|@q$:7 @sZPC3@$:7 @sZzA%\И-@a$:7 @sZhDE d@^$FP@sZGW#J)H^] @sI!ѸT4@sZ>SJxsd@ !ѸT4@sZBՠFŋEz]@d*@sZTCoC6P:vD@D*@sZKl4ބ'x@Htn @sZDF0DL.g@Htn @sZbpMK`1ҽFΡV@rHtn @sZǙMTK/(H@RHtn @sZթLҿjbDp@bHtn @sZFyxJyb@BHtn @sZ`bwDd(@$:7 @sZIsY/N@$:7 @sZ|8_vNRrC@ $:7 @sZb$G>H@$:7 @sZI%]@&mF@ +ۏ*Cluster member<2> = 3@y*d !G $U@)1@">VLL2FXVn@sI!ѸT4@sZPV2&GdF @q$:7 @9sZJOhQz*}a@RHtn @9sZPv.rBD @$:7 @9sZ~DS-qe﴿@RHtn @sZڥF-$~.@bHtn @sZ(0Oεt@ $:7 @9sZ,!pqGӅ=5@Htn @sZC]΍OjzV%0@^$FP@sZ * gKK&1%@BHtn @9sZZEH¼@$:7 @9sZPB@# @)1@">V*Cluster member<2> = 4@n`n@F݊h@( $6@!2FpA+V.p@a$:7 @sZuGغaBUO@Htn @ysZRk nrRGBlus#@Htn @ysZG'GHdF@rHtn @ysZ$X@-v@$:7 @sZC~3M4o_`@q$:7 @sZx߃ L@.{5i@d*@ysZYH&IN^s {I#@%C)W?C`h+SJ6@ !ѸT4@ysZqO؈3cʡV@sI!ѸT4@ysZE,㷻۩@bHtn @ysZts|,IV:n @^$FP@ysZ،<wC|g3{Oi@( $6@!2BClustering - 14-Oct-2014 15:56:14?kYiS\WY?>22 serialization::archive 11 0 1 1 27 CVChemicalSpaceLayoutEngine 1 0 0 0 0 1.60000000000000000e+001 1.80000000000000000e+002 -1.00000000000000000e+000 -1.00000000000000000e+000 1.00000000000000000e+000 1 0GG<Custom>@`@f@^@1MS Shell Dlg 22@1@^@VMS Shell Dlg 22@Z@@^@1MS Shell Dlg 22Compound ID@^@^@1MS Shell Dlg 22NK2 pKi@a`@^@1MS Shell Dlg 22logS@^@1MS Shell Dlg 22@1@^@PMS Shell Dlg 22@U4@^@Q@MS Shell Dlg 22@`@f@\@1333333MS Shell Dlg 22n of N (--%)@1333333@\@aٙMS Shell Dlg 22Singletons~ ɰ1+XVjYlWuOz% WT6@(qnp@!\.~y\J3 ,~ҧҸYH&IN^@(qnx@!\.~yMCS Cluster = 1@@iF - ܽ (K#ӽlh@(#f{ @!33 f(u@ݖz2߽rYҧҸ@~HC㍽"+@e@_EM(@V R@~<B̃mCV7@3@vD.&KJğ~$@@90"5[A*︎咴@|+-X-H@GʛL\xOy@ɊV R@>dVrI }cW~ҧҸ@!EfDnAl!}I~ҧҸ@^o*Gr!@V R@,r|@DQ x@e@@%O;1@V R@Q(N@ރFӒzk@يV R@16m@,BXR^@e@X[rgJ`C9*s@ɊV R@@𦅀OL-+"XVZgSJJ@n1_Gz۝\@ɊV R@<ОO0|X@|+-X-H@X;HMS Fi*@V R@YO[SHRS_rYҧҸ@n؞a0Kf<&@ɊV R@"3njMT/6@@"XCd@T` @ L,Nιplq{q@eO2^[N'á@يV R@. MrJ9D`@يV R@Fdn̡OpLӮM4@V R@Ym\HȒ*ɩ!ZgSJJ@~<{S@FrYҧҸ@@9wG7S`@e@"E?BSC?ݘ@V R@@&>L$@@De@ң|?/@aVaPܳ@ɊV R@~3ӵF!2tN'iS\@u@ʀP:+D@|+-X-H@nv.OLӲw"B@e@pJDOrU `L@3@~ʊCo_uW;@e@n{pUĤ@RnozViS\@IZGUsꨂ@@ B+Jm܄ }@De@@4?7E88@e@vKݩ6@De@3Jƅ[]FXE@(#f{ @!33 f MCS Cluster = 10@^m`n@F݊h@!4h@@ | uGغaBUO@4e@Rk nrRGBlus#iS\@`G'GHdF~ҧҸ@`E,㷻۩@@`،<wC|g3{Oi@!4h@@ |  MCS Cluster = 11@P@O` ,ԠA_:)@)ήa^@"2=2%a]Cn7,J8rYҧҸ8SH@TZgSJJ@O]ge@Y%pbhiS\@@Y.ʋE>@يV R@nYiAr@@T` @JC4N@V R@~DB*PiS\@~8wAFì~5`tDe@)ήa^@"2=2 MCS Cluster = 12@GFpA+V.p@s`Ω @=$X@-vrYҧҸ@`C~3M4o_`@s`Ω @= MCS Cluster = 13@~@@݆ 9K%Gtx*@) @":@4#`u@V R@n Kyo\Ƅ@p+-X-H@nI&OɝMJOZgSJJ@ KMMᝨ?y@e:RMT ~ҧҸ@l[^CzTVr@e@ΰzaK V@V R@6?CS\%i@) @":MCS Cluster = 2@@ *ȰmhH˸6 O@)L@!/@PHo~qLU ~ҧҸ@p8m/D֑$}ZgSJJ@ %~MA%[@De@iS\@nL }G{uJb@|+-X-H@b+Kh)ZZgSJJ@zk?E0@e@GGNX%E@ZgSJJ@ =UJ\NL@V R@dK3.3@V Rm+HKQGo@يV R@J rN >3@@يV R@@𒏙OaoI@e@+MF2Ib@e@+|:OF"N@3@iS N*@@nUg[GZ^~@2*oLGvNAJ$V@7dO;uJ@يV R@~5`HD$@@@J+{@)L@!/@MCS Cluster = 3@m@UѠJOhQz*}a@'kHH@@!͚ * gKK&1%@V R@Pv.rBD @3@裍JXσ rYҧҸ@(0Oεt@V R@ZEH¼@V R@+~M%Z4@يV R@PV2&GdF @p+-X-H@}2H V@T` @q㌑4N@\x@@C]΍OjzV%0@ɊV R@LL2FXVn@T` @Ou5L]L@|+-X-H@!G $UZgSJJ@¹ MʢIr@@~,!pqGӅ=5@يV R@PB@# @e@QC0dFaJIrYҧҸ@ڥF-$~.@@~DS-qe﴿@@&d7IVм]!k@'kHH@@!͚MCS Cluster = 4@`@>/H"FKپ^qg{@$0n@k`5jhKe5v,@p+-X-Hw a`HjC@4e@CLe2{@@>âQ1Hf嶉(Z@4e@928Mb<%D@V R@O@@")Hٟ}}V#ZgSJJ@' ANhX)@@'8AGXh4U@3@96KJ^/@p+-X-H@@鉚HI6nZos@4e@~jiS]tF6_@V R@A`OoHXo@De@xI EN7M~ҧҸ@N>v@􆨣0<;iS\@މRHV]ް@T` @n{Gf|Wr@p+-X-H@ Gƒw@3@@7tB Ucw@يV R@y1OUF/<^rYҧҸ@֬Ep&QgiS\@Mw@Iڣ^+;rYҧҸ@AcAO̚MD`ި@|+-X-HuMksǒҵ@De@nRI Oo @4e@n1G.ěHot0@3@gx{Db\&^@e@@s$,H]IЭ~v@4e@@>N!J](@3@V@2kN9&<+=@4e@A3./r9JVX|@e@@Lq6u&@T` @@+KO#Pf@$0n@k`MCS Cluster = 5@ @ȵ0WBe< vqW@%`0@/KhOwWCCS0\l@p+-X-H@~&"#LL'L{@@Ō_Fܫ'C rYҧҸ@•cI5;^u("@4e@ 1>xN ?/@e@kv,BߌW9C@V R@EJAa@r&d&?@V R@@Ȝ? Ngm여@3@nO-``H)!yb@@~ X@O@@FAOT6@ɊV R@EG9'G93@V R@|YEĺI@3@!N?GW@@V RaIN]x'@V R@n\ՋME )@V R@a,NyziS\@yRL_M`-N@|+-X-H@ J@ @De@6*C}pq,@%`0@/MCS Cluster = 6@@N*5A6Hz@&O5g@-y9<=@$:ž@V R@daH"(#@@2El-y@&O5g@MCS Cluster = 7@@)oB5.F\R@'7i@!Gƀ+g2KA`vO@V R@~ 8zGޜ ZgSJJ@ C3\K7҂s1@V R@ާtbqPEBEv~QȟiS\@GU.Hoyl~ҧҸ@]03Lܣ]GrYҧҸ@oI[,[|ZgSJJ@PC3@T` @zA%\И-@p+-X-H@hDE d@|+-X-H@GW#J)H^] @3@>SJxsd@@BՠFŋEz]@@TCoC6P:vD@V R@Kl4ބ'x@يV R@DF0DL.g@ɊV R@bpMK`1ҽFΡV@V R@ǙMTK/(H@V R@թLҿjbDp@e@FyxJyb@De@`bwDd(@e@IsY/N@4e@|8_vNRrCiS\@b$G>H~ҧҸ@I%]@**@"T`fMCS Cluster = 9@R@i`x߃ L@.{5i@)+M@";\C)W?C`h+SJ6@|+-X-H@`qO؈3cʡV@3@`ts|,IV:n @)+M@";\JMCS Clustering - 14-Oct-2014 15:57:28??zn 61+XV22 serialization::archive 11 0 1 1 27 CVChemicalSpaceLayoutEngine 1 0 0 0 0 1.60000000000000000e+001 1.80000000000000000e+002 -1.00000000000000000e+000 -1.00000000000000000e+000 1.00000000000000000e+000 1 0GG<Custom>@`@f@^@1MS Shell Dlg 22@1@^@VMS Shell Dlg 22@Z@@^@1MS Shell Dlg 22Compound ID@^@^@1MS Shell Dlg 22NK2 pKi@a`@^@1MS Shell Dlg 22logS@^@1MS Shell Dlg 22@1@^@PMS Shell Dlg 22@U4@^@Q@MS Shell Dlg 22@`@f@\@1333333MS Shell Dlg 22n of N (--%)@1333333@\@aٙMS Shell Dlg 22 Singletons~g?8<\mjYlWuOz% WT6@ ɔ@!oywc\J3 ,s ɰ1+XVYH&IN^@ ɔ@!oywcMCS Cluster = 1@f!@ˀ- ܽ (K#ӽlh@*{@" f (u@ݖz2߽@z?'@|EzzHC㍽"+@@|Ezz_EM(@@|Ezz<B̃mCV7@@|EzzvD.&KJğ~$@@|Ezz90"5[A*︎咴@{@|EzzGʛL\xOy@ޏ@|Ezz>dVrI }cW@-ޏ@|Ezz!EfDnAl!}I@ޏ@|Ezz^o*Gr!@ޏ@|Ezz,r|@DQ x@ޏ@|Ezz%O;1~ ɰ@==JQ(N@ރFӒzks ɰ@==J16m@,BXR^]D.&´@==JX[rgJ`C9*s@Q=L@==J𦅀OL-+"XV@p.~6OS@==J1_Gz۝\@{~6OS@==J<ОO0|X@z?'@==JX;HMS Fi*@z?'@==JYO[SHRS_@z?'@==J؞a0Kf<&@@==J"3njMT/6@@==J"XCd@@==J L,Nιplq{q@@==JO2^[N'á@{@==J. MrJ9D`@ޏ@==JFdn̡OpLӮM4@-ޏ@==JYm\HȒ*ɩ!@ޏ@==J<{S@F@ޏ@==J9wG7S`@ޏ@==J"E?BSC?ݘ~ ɰ@v==J&>L$@s ɰ@v==Jң|?/@aVaPܳ]D.&´@v==J3ӵF!2tN'@Q=L@v==Ju@ʀP:+D@p.~6OS@v==Jv.OLӲw"B@{~6OS@v==JpJDOrU `L@z?'@v==JʊCo_uW;@z?'@v==J{pUĤ@RnozV@z?'@v==JIZGUsꨂ@@v==J B+Jm܄ }@@v==J4?7E88@@v==JvKݩ6@@v==J3Jƅ[]FXE@*{@" f  MCS Cluster = 10@ @s ,ԠA_:)@);`@""(@%a]Cn7,J8@@{Q}8SH@T@@{Q}O]ge@Y%pbh@@{Q}Y.ʋE>@z?'@{Q}YiAr@@z?'@{Q}JC4N@z?'@{Q}DB*P@{~6OS@{Q}8wAFì~5`tDe@);`@""(@ MCS Cluster = 11@,;@SD FpA+V.p{ǡ%$X@-v]D.&´@{Q}C~3M4o_`{ǡ% MCS Cluster = 12@`@0 9K%Gtx*@%?@/g@4#`u@ޏ@{Q} Kyo\Ƅ@-ޏ@{Q}I&OɝMJO@ޏ@{Q} KMMᝨ?y@ޏ@{Q}:RMT @ޏ@{Q}l[^CzTVr~ ɰ@;Q}ΰzaK Vs ɰ@;Q}6?CS\%i@%?@/gMCS Cluster = 2@nU @ *ȰmhH˸6 O@*H;@"y4pPHo~qLU @{~6OS@|Ezzp8m/D֑$}@p.~6OS@|Ezz %~MA%[@Q=L@|Ezz@]D.&´@|EzzL }G{uJbs ɰ@|Ezzb+Kh)Z~ ɰ@|Ezzzk?E0@ޏ@kڋ&GGNX%E@@ޏ@kڋ& =UJ\NL@ޏ@kڋ&dK3.3@-ޏ@kڋ&m+HKQGo@ޏ@kڋ&J rN >3@@{@kڋ&𒏙OaoI@@kڋ&+MF2Ib@@kڋ&+|:OF"N@@kڋ&iS N*@@kڋ&Ug[GZ^~@z?'@kڋ&2*oLGvNAJ$V@1+XV7dO;uJ@z?'1+XV5`HD$@z?'1+XVJ+{@*H;@"y4pMCS Cluster = 3@B@JOhQz*}a@)ڡU@"/H"FKپ^qg{@*-mT@"^/A:5jhKe5v,@{@Q}w a`HjC@ޏ@Q}CLe2{@p.~6OS@OR>âQ1Hf嶉(Z@{~6OS@OR928Mb<%D@z?'@ORO@z?'@OR")Hٟ}}V#@z?'@OR' ANhX)@@OR'8AGXh4U@@OR96KJ^/@@OR鉚HI6nZos@@ORjiS]tF6_@{@ORA`OoHXo@ޏ@ORxI EN7M@-ޏ@ORN>v@􆨣0<;@ޏ@ORމRHV]ް@ޏ@OR{Gf|Wr@ޏ@OR Gƒws ɰ@}OR7tB Ucw]D.&´@}ORy1OUF/<^@Q=L@}OR֬Ep&Qg@p.~6OS@}ORMw@Iڣ^+;@{~6OS@}ORAcAO̚MD`ި@z?'@}ORuMksǒҵ@z?'@}ORRI Oo @z?'@}OR1G.ěHot0@@}ORgx{Db\&^@@}ORs$,H]IЭ~v@@}OR>N!J](@@}ORV@2kN9&<+=@{@}ORA3./r9JVX|@ޏ@}OR@Lq6u&@-ޏ@}OR+KO#Pf@*-mT@"^/A:MCS Cluster = 5@1@Aȵ0WBe< vqW@)R3@!tTrKhOwWCCS0\l@@Q}&"#LL'L{@@Q}Ō_Fܫ'C @z?'@Q}•cI5;^u("@z?'@Q} 1>xN ?/@z?'@Q}kv,BߌW9C@{~6OS@Q}EJAa@r&d&?@p.~6OS@Q}Ȝ? Ngm여@Q=L@Q}O-``H)!yb]D.&´@Q} X@Os ɰ@Q}FAOT6~ ɰ@Q}EG9'G93@ޏ@Q}|YEĺI@ޏ@Q}!N?GW@@ޏ@Q}aIN]x'@-ޏ@Q}\ՋME )@ޏ@Q}a,Nyz@{@Q}yRL_M`-N@@Q} J@ @@Q}6*C}pq,@)R3@!tTrMCS Cluster = 6@0@!@oB5.F\R@(F @!#a+g2KA`vO@z?'@Q} 8zGޜ @z?'@Q} C3\K7҂s1@z?'@Q}ާtbqPEBEv~Qȟ~ ɰ@]ORGU.Hoyls ɰ@]OR]03Lܣ]G]D.&´@]ORoI[,[|@Q=L@]ORPC3@p.~6OS@]ORzA%\И-@{~6OS@]ORhDE d@z?'@]ORGW#J)H^] @z?'@]OR>SJxsd@z?'@]ORBՠFŋEz]@@]ORTCoC6P:vD@@]ORKl4ބ'x@@]ORDF0DL.g@@]ORbpMK`1ҽFΡV@{@]ORǙMTK/(H@ޏ@]ORթLҿjbDp@-ޏ@]ORFyxJyb@ޏ@]OR`bwDd(@ޏ@]ORIsY/N@ޏ@]OR|8_vNRrC~ ɰ@=ORb$G>Hs ɰ@=ORI%]@(=7&@!3ƀMCS Cluster = 8@d@UVx߃ L@.{5i@'5@쀸bC)W?C`h+SJ6@p.~6OS@=ORqO؈3cʡV@{~6OS@=ORts|,IV:n @'5@쀸bMCS Cluster = 9@J@`n@F݊h@):|@" uGغaBUO@-ޏ@v==JRk nrRGBlus#@ޏ@v==JG'GHdF@ޏ@v==JE,㷻۩@ޏ@v==J،<wC|g3{Oi@):|@" JMCS Clustering - 14-Oct-2014 15:59:02? \ 2>VbL<\p22 serialization::archive 11 0 1 1 27 CVChemicalSpaceLayoutEngine 1 0 0 0 0 1.60000000000000000e+001 1.80000000000000000e+002 -1.00000000000000000e+000 -1.00000000000000000e+000 1.00000000000000000e+000 1 0GG<Custom>@`@f@^@1MS Shell Dlg 22@1@^@VMS Shell Dlg 22@Z@@^@1MS Shell Dlg 22Compound ID@^@^@1MS Shell Dlg 22NK2 pKi@a`@^@1MS Shell Dlg 22logS@^@1MS Shell Dlg 22@1@^@PMS Shell Dlg 22@U4@^@Q@MS Shell Dlg 22@`@f@\@1333333MS Shell Dlg 22n of N (--%)@1333333@\@aٙMS Shell Dlg 22 Singletons KalN@h\jYlWuOz% WT6@= @@A]@`}}\J3 ,s4g?8<\mYH&IN^@= @@A]@`MCS Cluster = 1JOhQz*}a@(@P0@!v o * gKK&1%@{u<\mPv.rBD @p u@-t55裍JXσ ]+@-tII(0Oεt@`d@jhj-E{{ZEH¼@ź`d<\m+~M%Z4~g?8<\mPV2&GdF s4g?8@jhj-E}2H V@`d@-t??q㌑4N@\x]+@-t55C]΍OjzV%0@p u@F$!!LL2FXVn~g?8@-t77Ou5L]L@Q-fc <\m!G $U@`d@FF$¹ MʢIr]+<\m,!pqGӅ=5@`d<\mPB@# @Ff02<\mQC0dFaJIs4g?8@-tIIڥF-$~.s4g?8@F$~DS-qe﴿@Ff02@-t22&d7IVм]!k@(@P0@!v o66MCS Cluster = 2@g<@qWYO[SHRS_@)Y!@! ΀++O2^[N'á@p u@ EI++i_/ A ~g?8@fF$ %~MA%[]+@EI''>GvNAJ$V@Q-fc @MEH//5`HD$@`d@F$##,r|@DQ x]+@ƋF$(u@ݖz2߽~g?8@ EI,,3Jƅ[]FXE]+@EQn ң|?/@aVaPܳ@Q-fc @F$ =UJ\NL]+@F$GʛL\xOy]+@ EI,,7dO;uJ@p u@fF$u@ʀP:+D@`d@EI)) L,Nιplq{q@{u@F$$$UosIn=@{u@F$vKݩ6@ź`d@MEH..c$h 8Mȍ@`d@sEQnm+HKQGo@Q-fc @ƋF$@]+@SEQnY DL$@@Q-fc @-t55pJDOrU `L@ź`d@F$$$v.OLӲw"B@ź`d@fF$"3njMT/6@`d@EI))b+Kh)Z@Ff02@EQn16m@,BXR^~g?8@F$CIƈ0ۺs4g?8@F$GGNX%E@~g?8@&F$J rN >3@@Ff02@&F$iG>{~g?8@cEQn>dVrI }cW@Q-fc @F$%%𒏙OaoI@Ff02@EQnEAJa-HeY@p u@|4Z5"]]<B̃mCV7@Q-fc @FF$%O;1@{u@EI))J+xN ?/@`d@F$kv,BߌW9C@`d@ EI++EJAa@r&d&?@ź`d@-t@@Ȝ? Ngm여s4g?8@F$##O-``H)!yb@Ff02@EQn ާtbqPEBEv~Qȟ@p u@MEH..GU.Hoyl]+@EQn]03Lܣ]G@{u@EI&&oI[,[|@`d@EQnPC3@Q-fc @fF$hDE d@`d@ƋF$GW#J)H^] @ź`d@FF$>SJxsd@`d@|4Z5"YYzA%\И-]+@cEQnBՠFŋEz]@Ff02@F$##TCoC6P:vD@Ff02@EQnDF0DL.g@ź`d@EQn Kl4ބ'x@p u@cEQnbpMK`1ҽFΡV@p u@jhj-EթLҿjbDp@`d@EQnǙMTK/(H@Ff02@cEQnFyxJyb~g?8@FF$`bwDd(@`d@|4Z5"NNIsY/N~g?8@EQn|8_vNRrCs4g?8@cEQnb$G>H@`d@EQn I%]@'$O?@ ޓt4MCS Cluster = 5@x@@zx߃ L@.{5i@ ɖ..@ =Q((qO؈3cʡV@{u@fF$C)W?C`h+SJ6@ź`d@cEQnts|,IV:n @ ɖ..@ =Q22MCS Cluster = 6@qf@yC>/H"FKپ^qg{@);aG4@!8V!!5jhKe5v,@`d@MEH--w a`HjC@`d@F$CLe2{@Q-fc @-tFF>âQ1Hf嶉(Z@ź`d@EQn 928Mb<%D@{u@&F$O@Q-fc @F$")Hٟ}}V#@{u@F$' ANhX)~g?8@ƋF$'8AGXh4U@p u@EQn 96KJ^/~g?8@EQn鉚HI6nZos@Ff02@FF$jiS]tF6_@`d@&F$xI EN7Ms4g?8@EI**A`OoHXo@{u@F$N>v@􆨣0<;@`d@fF$މRHV]ް@p u@EQn {Gf|Wr@`d@EQn  Gƒw@ź`d@F$7tB Ucw@ź`d@ƋF$y1OUF/<^@{u@EQn ֬Ep&Qg@ź`d@F$AcAO̚MD`ި@p u@EQnMw@Iڣ^+;@{u@ƋF$uMksǒҵ]+@EQnRI Oo ]+@EQn 1G.ěHot0@p u@EQn gx{Db\&^@`d@EQns$,H]IЭ~v~g?8@EI++>N!J](]+@&F$V@2kN9&<+=s4g?8@EQnA3./r9JVX|s4g?8@fF$@Lq6u&@ź`d@F$+KO#Pf@);aG4@!8VMCS Cluster = 7@@`n@F݊h@*_,`@".l8 uGغaBUO@p u<\mG'GHdF@Q-fc @EQn Rk nrRGBlus#~g?8@EQn E,㷻۩@Q-fc @F$##،<wC|g3{Oi@*_,`@".l0MCS Cluster = 8@m< @u`%a]Cn7,J8@(--g@!:?A88SH@T@Ff02@MEH,,:RMT ]+@|4Z5"ee8wAFì~5`tDes4g?8@ƋF$DB*P@Q-fc @cEQnI&OɝMJO@`d<\m,ԠA_:)]+@fF$9K%Gtx*@Ff02@jhj-E{{O]ge@Y%pbh@p u@ƋF$ KMMᝨ?y@p u@F$ Kyo\Ƅ@`d@F$@4#`u@`d@jhj-E||Y.ʋE>s4g?8@F$6?CS\%i]+@MEH00l[^CzTVrs4g?8@SEQnYiAr@@Ff02@F$ JC4N@ź`d@EQnΰzaK V@(--g@!:?A0MCS Cluster = 9@ʪ@ʀFpA+V.p@(Lz@7 $X@-v@ź`d@|4Z5"[[C~3M4o_`@(Lz@7 )i C#A?X{5*?;dZJMCS Clustering - 14-Oct-2014 16:08:15?2$?9sX22 serialization::archive 11 0 1 1 27 CVChemicalSpaceLayoutEngine 1 0 0 0 0 1.60000000000000000e+001 1.80000000000000000e+002 -1.00000000000000000e+000 -1.00000000000000000e+000 1.00000000000000000e+000 1 0GG<Custom>@`@f@^@PGvNAJ$V@{p@UOP5`HD$^-=8@ڧh,r|@DQ x^-=8@UmS4(u@ݖz2߽@oi=&d@MUOP3Jƅ[]FXE KalN@UmS4ң|?/@aVaPܳs`KalN@UmS4 =UJ\NL KalN@UmS4GʛL\xOy@OIY@MUOP7dO;uJ^-=8@Fڧhu@ʀP:+D@{p@ڧh L,Nιplq{q@OIY@ڧhUosIn=s`KalN@UmS4vKݩ6 KalN@MUOPc$h 8Mȍ@OIY@3UmS4m+HKQGo@P~zM@UmS4@@oi=&d@UmS4ZZY DL$@@P~zM@UOPpJDOrU `L KalN@ڧhv.OLӲw"B@oi=&d@Fڧh"3njMT/6@OIY@ڧhb+Kh)Zs`KalN@cUmS416m@,BXR^^-=8@UmS4CIƈ0ۺ@{p@ڧhGGNX%E@^-=8@ڧhJ rN >3@@P~zM@ڧhiG>{ KalN@#UmS4>dVrI }cW@{p@ڧh𒏙OaoI@{p@CUmS4EAJa-HeY KalN@j<B̃mCV7@P~zM@&ڧh%O;1@P~zM@ڧhJ+xN ?/@oi=&d@UmS4kv,BߌW9C@P~zM@ UOPkkEJAa@r&d&?@oi=&d@jssȜ? Ngm여@{p@ڧhO-``H)!yb@{p@UmS4``ާtbqPEBEv~Qȟ@OIY@UOP__GU.Hoyl@oi=&d@cUmS4TT]03Lܣ]G@{p@ƪڧhaaoI[,[|^-=8@SUmS4**PC3s`KalN@FڧhTThDE d@OIY@UmS4IIGW#J)H^] @OIY@&ڧhTT>SJxsd@P~zM@jffzA%\И-^-=8@#UmS400BՠFŋEz]@P~zM@ڧhTTTCoC6P:vD@P~zM@SUmS4%%DF0DL.g^-=8@UmS4HHKl4ބ'x@oi=&d@#UmS4bpMK`1ҽFΡV@OIY@njzթLҿjbDp@oi=&d@CUmS466ǙMTK/(Hs`KalN@UmS4FyxJyb KalN@&ڧhTT`bwDd(@oi=&d@jxxIsY/N@oi=&d@SUmS400|8_vNRrCs`KalN@#UmS4IIb$G>H@OIY@sUmS4<<I%]@)]@"/66MCS Cluster = 5@x@@zx߃ L@.{5i@'9Aa{ @ tyMy@TTqO؈3cʡV@P~zM@FڧhaaC)W?C`h+SJ6@OIY@#UmS4ts|,IV:n @'9Aa{0@ tyMy@ggMCS Cluster = 6@qf@yC>/H"FKپ^qg{@)`':@!*ȭ~~5jhKe5v,s`KalN@MUOPw a`HjC@OIY@UmS4CLe2{s`KalN@j>âQ1Hf嶉(Z@OIY@sUmS4^^928Mb<%D@OIY@ڧhO@OIY@ڧh")Hٟ}}V#@P~zM@UmS4' ANhX) KalN@UmS4'8AGXh4U KalN@UmS496KJ^/^-=8@cUmS4]]鉚HI6nZoss`KalN@ڧhjiS]tF6_^-=8@ڧhxI EN7M@OIY@ UOPA`OoHXo@OIY@UmS4N>v@􆨣0<;@{p@FڧhމRHV]ް@oi=&d@sUmS4ll{Gf|Wr@P~zM@UmS4 Gƒw KalN@UmS4yy7tB Ucw@OIY@UmS4y1OUF/<^@P~zM@UmS4bb֬Ep&Qg@oi=&d@UmS4AcAO̚MD`ި@OIY@cUmS4ccMw@Iڣ^+;@{p@UmS4uMksǒҵ@OIY@SUmS4ppRI Oo @OIY@UmS41G.ěHot0^-=8@UmS4gx{Db\&^s`KalN@SUmS4ggs$,H]IЭ~v@OIY@ UOP>N!J](@oi=&d@ڧhV@2kN9&<+=@P~zM@cUmS4||A3./r9JVX|@OIY@fڧh@Lq6u&^-=8@UmS4+KO#Pf@)`':@!*ȭwwMCS Cluster = 7@@`n@F݊h@!)Y_G@>>PQQuGغaBUO@oi=&d@ jG'GHdF@P~zM@sUmS4UURk nrRGBlus#@OIY@UmS4//E,㷻۩@OIY@ڧhXX،<wC|g3{Oi@!)Y_G@>>@MCS Cluster = 8@m< @u`%a]Cn7,J8@*Vu>@""ff8SH@T@P~zM@MUOPcc:RMT @OIY@~5V=CD8wAFì~5`tDes`KalN@UmS4DB*P@P~zM@#UmS4YYI&OɝMJO KalN@njz,ԠA_:) KalN@Fڧh9K%Gtx*@P~zM@~5V=CDO]ge@Y%pbh@oi=&d@UmS4 KMMᝨ?y KalN@UmS4 Kyo\Ƅ@{p@UmS4@4#`us`KalN@~5V=CDY.ʋE>@P~zM@UmS46?CS\%i@oi=&d@UOPl[^CzTVr@P~zM@UmS4@@YiAr@@{p@fڧhJC4N KalN@SUmS4ffΰzaK V@*Vu>@""MCS Cluster = 9@ʪ@ʀFpA+V.p@U>@@(õ""$X@-v^-=8@jC~3M4o_`@U>@@(õaCnCJF@333333@# =p JMCS Clustering - 14-Oct-2014 16:28:37?๹lp8rv@L22 serialization::archive 11 0 1 1 27 CVChemicalSpaceLayoutEngine 1 0 0 0 0 1.60000000000000000e+001 1.80000000000000000e+002 -1.00000000000000000e+000 -1.00000000000000000e+000 1.00000000000000000e+000 1 0GG<Custom>@`@f@^@Pv@􆨣0<;S@ji,?'COz0s@.YMDLj[wV@~@ o)fJ@vieB@)enp@"" MCS Cluster = 11@o^ FpA+V.p@%o\K@#m""$X@-v_LGpx@(]vC~3M4o_`@%o\K@#m MCS Cluster = 12@0@P` @4#`u@'þvL}@ 29K%Gtx*@Og q@PLf Kyo\Ƅ@Og q@ oI&OɝMJOS@pPLf KMMᝨ?ys@ ol[^CzTVrs@U o@@:RMT @~@PLfΰzaK V@oY\G@pPLf6?CS\%i@'þvL}@ 2MCS Cluster = 2@@DWYO[SHRS_@(t"@!w(O2^[N'á@~@.Yi_/ A _LGpx@i, %~MA%[S@i,>GvNAJ$V@oY\G@.Y5`HD$S@i,,r|@DQ x@v~@ o(u@ݖz2߽_LGpx@.Y3Jƅ[]FXE@v~@ oң|?/@aVaPܳS@ o =UJ\NL@v~@ oGʛL\xOy@oY\G@.Y7dO;uJ@{l.#@i,u@ʀP:+D@Og q@ i, L,Nιplq{q@{l.#@i,UosIn=_LGpx@ ovKݩ6@v~@.Yc$h 8Mȍ@{l.#@u om+HKQGoS@ o@_LGpx@U oZZY DL$@_LGpx@.YpJDOrU `L@~@i,v.OLӲw"B@v~@i,"3njMT/6@oY\G@ i,b+Kh)Z@{l.#@ o16m@,BXR^@{l.#@ oCIƈ0ۺ@~@*i,GGNX%E@@oY\G@Ji,J rN >3@@oY\G@*i,iG>{@v~@u o>dVrI }cW@Og q@i,𒏙OaoI@~@ oEAJa-HeYS@(]v<B̃mCV7@{l.#@ji,%O;1s@ i,J+xN ?/@Og q@ okv,BߌW9Cs@T.YkkEJAa@r&d&?@Og q@]vssȜ? Ngm여@Og q@i,O-``H)!yb@oY\G@ o``ާtbqPEBEv~Qȟ@{l.#@.Y__GU.Hoyl@v~@ oTT]03Lܣ]G@Og q@i,aaoI[,[|@Og q@ o**PC3@oY\G@i,TThDE d@Og q@ oIIGW#J)H^] S@Ji,TT>SJxsd@Og q@(]vffzA%\И-s@e o00BՠFŋEz]s@i,TTTCoC6P:vD@oY\G@ o%%DF0DL.g_LGpx@ oHHKl4ބ'x@Og q@e obpMK`1ҽFΡV@~@pPLfթLҿjbDp@{l.#@ o66ǙMTK/(H@v~@e oFyxJyb_LGpx@ji,TT`bwDd(@oY\G@(]vxxIsY/N@{l.#@ o00|8_vNRrCS@e oIIb$G>H@Og q@ o<<I%]@)fdx9a@!{ظ66MCS Cluster = 5@eٷ`@R)J@x߃ L@.{5i@(,^ j@!9TXTTqO؈3cʡV@~@i,aaC)W?C`h+SJ6@{l.#@e ots|,IV:n @(,^ j@!9TXggMCS Cluster = 6@)@c ")Hٟ}}V#@(ˬ@!+AsBgxwAm>w_LGpx@ oyyNj0'CQ,:H7@{l.#@ o鉚HI6nZos@Og q@Ji,g\GJj:Ms@Ji,7tB Ucw_LGpx@ oK@̀e6Us@ oxh=K,AQL @~@ offw a`HjC@oY\G@ oDB*P_LGpx@e oYY`EKZl_LGpx@ onnމRHV]ްs@ oll GƒN!J](@~@Ji,㷢CrO9p@{@Og q@ji,A`OoHXos@ o5jhKe5v,S@.YzKib_G8+S@ i,OS@ oƛPQG@ػ@v~@ i,{Avd%m S@u ouMksǒҵ@v~@ oppxI EN7M@{l.#@T.Yo'Fvo2Fs@u occs$,H]IЭ~v@oY\G@T.Y_PEITUFr@v~@ji,C@`@f@^@Pv@􆨣0<;@@ xT@m?'COz0@K*}@mMDLj[wV@K*}@m)fJ@vieB@( x@!c MCS Cluster = 11@o^ FpA+V.p@/W@""$X@-v@a.@} C~3M4o_`@/W@ MCS Cluster = 12@0@P` @4#`u@'7zj@@ `9K%Gtx*@@ xT@}  Kyo\Ƅ@K*}@} I&OɝMJO@K*}@}  KMMᝨ?y@K*}@} l[^CzTVrs@{k@@:RMT @{kΰzaK V`{G=X,@{k6?CS\%i@'7zj@@ `MCS Cluster = 2@@DWYO[SHRS_@*Gܺl@"y@O2^[N'á@{\-S@{ki_/ A @a.@{k %~MA%[@A.@{k>GvNAJ$V@!.@{k5`HD$@ xT@{k,r|@DQ x@p xT@{k(u@ݖz2߽@` xT@{k3Jƅ[]FXE@@ xT@{kң|?/@aVaPܳ@P xT@{k =UJ\NL@K*}@{kGʛL\xOy@K*}@{k7dO;uJ@K*}@{ku@ʀP:+D@K*}@{k L,Nιplq{qs@kUosIn=@kvKݩ6`{G=X,@kc$h 8Mȍ@Lo P@km+HKQGo@n[§@k@@{\-S@kZZY DL$@`{G=X,@`pJDOrU `L@Lo P@`v.OLӲw"B@n[§@`"3njMT/6@{\-S@`b+Kh)Z@a.@`16m@,BXR^@A.@`CIƈ0ۺ@ xT@`GGNX%E@@!.@`J rN >3@@p xT@`iG>{@` xT@`>dVrI }cW@P xT@`𒏙OaoI@@ xT@`EAJa-HeY@K*}@`<B̃mCV7@K*}@`%O;1@K*}@`J+xN ?/@a.@`kv,BߌW9C@A.@`kkEJAa@r&d&?@!.@`ssȜ? Ngm여@ xT@`O-``H)!yb@p xT@```ާtbqPEBEv~Qȟ@` xT@__GU.Hoyl@P xT@TT]03Lܣ]G@@ xT@aaoI[,[|@K*}@**PC3@K*}@TThDE d@K*}@IIGW#J)H^] @K*}@TT>SJxsd@ffzA%\И-s@00BՠFŋEz]`{G=X,@TTTCoC6P:vD@Lo P@%%DF0DL.g@{\-S@HHKl4ބ'x@n[§@bpMK`1ҽFΡV@a.@թLҿjbDp@!.@66ǙMTK/(H@A.@FyxJyb@ xT@TT`bwDd(@p xT@xxIsY/N@` xT@00|8_vNRrC@@ xT@IIb$G>H@P xT@<<I%]@)H@"(&"266MCS Cluster = 5@eٷ`@R)J@x߃ L@.{5i@ {@7ՀTTqO؈3cʡV@ xT@} aaC)W?C`h+SJ6@p xT@} ts|,IV:n @ {@7ՀggMCS Cluster = 6@)@c ")Hٟ}}V#@()d@!buBgxwAm>w@K*}@yyNj0'CQ,:H7s@鉚HI6nZos@g\GJj:M@K*}@7tB Ucw@Lo P@K@̀e6U`{G=X,@xh=K,AQL @n[§@ffw a`HjC@{\-S@DB*P@a.@YY`EKZl@A.@nnމRHV]ް@ xT@ll GƒN!J](@K*}@㷢CrO9p@{@K*}@A`OoHXo@@ xT@5jhKe5v,@K*}@zKib_G8+@~Os@~ƛPQG@ػ@Lo P@~{Avd%m `{G=X,@~uMksǒҵ@n[§@~ppxI EN7M@!.@~o'Fvo2F@A.@~ccs$,H]IЭ~v@a.@~_PEITUFr@{\-S@~C@`@f@^@Pv@􆨣0<;@qc@(F?'COz0@SuLy@(FMDLj[wV@4@(F)fJ@vieB@'U@ $ MCS Cluster = 11@o^ FpA+V.p@!&)-@zl""$X@-v@Wn3@@MqDC~3M4o_`@!&)-@zl MCS Cluster = 12@0@P` @4#`u@'cX@ Z9K%Gtx*@}zc@0(F Kyo\Ƅ@OSuLy@p(FI&OɝMJO@ަ4@a4Qƍ KMMᝨ?y@SuLy@qh$l[^CzTVr@4@a4Qƍ@@:RMT @4@4QƍΰzaK V@_SuLy@a4Qƍ6?CS\%i@'cX@ ZMCS Cluster = 2@@DWYO[SHRS_@*=K)@"IO2^[N'á@}M1h@qh$i_/ A @.4@qh$ %~MA%[@4@qh$>GvNAJ$V@4@qh$5`HD$@4@qh$,r|@DQ x@4@qh$(u@ݖz2߽@ަ4@qh$3Jƅ[]FXE@_SuLy@qh$ң|?/@aVaPܳ@SuLy@qh$ =UJ\NL@OSuLy@qh$GʛL\xOy}EdU30@a4Qƍ7dO;uJqdU30@a4Qƍu@ʀP:+DWVp@a4Qƍ L,Nιplq{q@qc@a4QƍUosIn=@Wn3@@a4QƍvKݩ6@}zc@a4Qƍc$h 8Mȍ@M1h@a4Qƍm+HKQGo@}M1h@a4Qƍ@@.4@a4QƍZZY DL$@@M1h@4QƍpJDOrU `L@}M1h@4Qƍv.OLӲw"B@.4@4Qƍ"3njMT/6@4@4Qƍb+Kh)Z@4@4Qƍ16m@,BXR^@4@4QƍCIƈ0ۺ@SuLy@4QƍGGNX%E@@ަ4@4QƍJ rN >3@@_SuLy@4QƍiG>{@OSuLy@4Qƍ>dVrI }cW}EdU30@a4Qƍ𒏙OaoIqdU30@a4QƍEAJa-HeYWVp@a4Qƍ<B̃mCV7@Wn3@@a4Qƍ%O;1@qc@a4QƍJ+xN ?/@_SuLy@(Fkv,BߌW9C@4@(FkkEJAa@r&d&?@.4@(FssȜ? Ngm여@SuLy@0(FO-``H)!yb@4@8MqD``ާtbqPEBEv~Qȟ@OSuLy@8MqD__GU.Hoyl}EdU30@MqDTT]03Lܣ]GqdU30@MqDaaoI[,[|WVp@MqD**PC3@Wn3@@MqDTThDE d@qc@MqDIIGW#J)H^] @}zc@MqDTT>SJxsd@M1h@MqDffzA%\И-@}M1h@MqD00BՠFŋEz]@.4@MqDTTTCoC6P:vD@4@MqD%%DF0DL.g@4@MqDHHKl4ބ'x@4@MqDbpMK`1ҽFΡV@4@MqDթLҿjbDp@SuLy@MqD66ǙMTK/(H@ަ4@MqDFyxJyb@_SuLy@MqDTT`bwDd(@SuLy@MqDxxIsY/N@OSuLy@MqD00|8_vNRrCqdU30@MqDIIb$G>H}EdU30@MqD<<I%]@)d+`@"G_66MCS Cluster = 5@eٷ`@R)J@x߃ L@.{5i@) ~)@!WTTqO؈3cʡV@}M1h@MqDaaC)W?C`h+SJ6@.4@MqDts|,IV:n @) ~)@!WggMCS Cluster = 6@)@c ")Hٟ}}V#@"2@`tBgxwAm>w@qc@MqDyyNj0'CQ,:H7@}M1h@MqD鉚HI6nZos@M1h@MqDg\GJj:M@}zc@MqD7tB Ucw@4@MqDK@̀e6U@.4@MqDxh=K,AQL @4@MqDffw a`HjC@4@MqDDB*P@4@MqDYY`EKZl@ަ4@MqDnnމRHV]ް@_SuLy@MqDll GƒN!J](@ަ4@8MqD㷢CrO9p@{@}M1h@(FA`OoHXo@Wn3@@(F5jhKe5v,}EdU30@(FzKib_G8+qdU30@8MqDO@4@(FƛPQG@ػ@qc@(F{Avd%m WVp@8MqDuMksǒҵ@4@8MqDppxI EN7MWVp@(Fo'Fvo2F@SuLy@(Fccs$,H]IЭ~v@4@8MqD_PEITUFr@.4@(FC@`@f@^@P = 1@w(@uJY DGvNAJ$V@ @'0*!N?GW@@ץ@6N` U^^Nj0'CQ,:H7@Co@'0*&d7IVм]!k@oץ@N` UdK3.3@ @'0* KMMᝨ?y@ @'0* %~MA%[@ @'0* L,Nιplq{q@co@'0*xh=K,AQL @o@'0*ff@@o@'0*ZZJ+{@ץ@-fGʛL\xOy@oץ@-fQ(N@ރFӒzk@Oץ@-fCL$@@So@-fv.OLӲw"B@o@-f?'COz0@ @['0*N>v@􆨣0<;@co@['0*Az;@o@['0*裍JXσ @Oץ@rl3{Avd%m @So@['0*Ou5L]L@o@rl3EAJa-HeY@Co@-f+|:OF"N@o@-fvD.&KJğ~$cСi@ fO2^[N'á@=z@ fFAOT6cСi@6N` U%O;1@k?/^\@ fΰzaK V@y_Kx.@ f 1>xN ?/@ @N` UUosIn=@ץ@ f𒏙OaoI@oץ@ f:RMT @Oץ@ fŌ_Fܫ'C @ @N` U``I&OɝMJO@ @ f}2H V@ @rl3zzo'Fvo2F@o@['0*cc90"5[A*︎咴@ @ f>N!J](@Co@['0*O@o@['0*oB5.F\R@co@6N` UYB Cy;4@ @ f'3EǤ-\@=z@'0*7tB UcwcСi@'0*`EKZl@k?/^\@'0*nnjiS]tF6_@y_Kx.@'0*oF@ɵ(@ @ f9wG7S`@ @ fw a`HjC@ץ@'0*6*C}pq,@o@6N` U<{S@F@co@ f2H(;WP#@oץ@'0*2*oLw@Oץ@'0*yy5`HD$@So@ fEJAa@r&d&?@o@N` UssJ rN >3@@o@ fX[rgJ`C9*s@Co@ f"E?BSC?ݘ@o@ fgx{Db\&^@=z@rl3gg B+Jm܄ }cСi@퓘f,r|@DQ x@=z@퓘fs$,H]IЭ~v@ @'0*3ӵF!2tN'@k?/^\@퓘fȵ0WBe< vqW@ @N` Uy1OUF/<^@ @'0*bbp8m/D֑$}@y_Kx.@퓘f<ОO0|X@oץ@퓘fȰmhH˸6 O@Oץ@퓘f3y+_J墢i[g@ץ@퓘f'8AGXh4U@ @'0*"3njMT/6@ @퓘f X@O@o@N` U^^㷢CrO9p@{@ @'0*1_Gz۝\@ @퓘f%+Ng%@ @͓fX;HMS Fi*@ @퓘f^o*Gr!@ @퓘f+MF2Ib@ @퓘fA`OoHXo@ @'0*HC㍽"+@co@퓘fV@2kN9&<+=@co@'0*||>dVrI }cW@o@퓘f9IE8U1Q@o@'0*Mw@Iڣ^+;@So@'0*")Hٟ}}V#@o@'0*i_/ A @So@퓘fK@̀e6U@Co@'0*MDLj[wV@o@'0*|YEĺI@y_Kx.@6N` U6?CS\%i@o@퓘fm+HKQGo@Co@퓘f\ՋME )@ @6N` Ukk؞a0Kf<&@o@퓘f_PEITUFrcСi@'0*4?7E88cСi@͓fdNoH[?zC@=z@͓f16m@,BXR^@k?/^\@͓f•cI5;^u("@ @N` U{pUĤ@RnozV@y_Kx.@͓fPHo~qLU @ץ@͓fQC0dFaJI@k?/^\@N` U)fJ@vieB@=z@'0* 8zGޜ @oץ@6N` UWW Gƒ = 2@@E4kE̠9=&@*@"ߚrrB- @o@6N` U<<Ô>Ev~Qȟ@Co@6N` U__GU.Hoyl@o@6N` UTT]03Lܣ]GcСi@N` UaaoI[,[|@=z@N` U**PC3@k?/^\@N` UTThDE d@y_Kx.@N` UIIGW#J)H^] @ץ@N` UTT>SJxsd@oץ@N` UffzA%\И-@Oץ@N` U00BՠFŋEz]@ @N` UTTTCoC6P:vD@ @N` U%%DF0DL.g@ @N` UHHKl4ބ'x@ @N` UbpMK`1ҽFΡV@ @N` UթLҿjbDp@co@N` U66ǙMTK/(H@o@N` UFyxJyb@So@N` UTT`bwDd(@o@N` UxxIsY/N@Co@N` U00|8_vNRrC@o@N` UIIb$G>HcСi@'0*<<I%]@*@"ߚ66*Cluster member<3> = 3@y*d !G $U@&/-!{@ jAccJOhQz*}a@y_Kx.@rl3hhLL2FXVn@So@rl3RRPV2&GdF @ @rl3Pv.rBD @oץ@rl3~DS-qe﴿@ץ@N` U}}ڥF-$~.@y_Kx.@N` U]](0Oεt@ @rl3,!pqGӅ=5cСi@N` UC]΍OjzV%0@o@rl3hh * gKK&1%@ץ@rl3ZEH¼@ @rl3PB@# @&/-!{@ jA*Cluster member<3> = 4@n `n@F݊h@) 5ۺ@!6QQFpA+V.p@ץ@'0*""uGغaBUO@ @'0*G'GHdF@ @'0*UURk nrRGBlus#@co@'0*//$X@-v@y_Kx.@'0*C~3M4o_`@k?/^\@'0*x߃ L@.{5i@ @'0*TTqO؈3cʡV@ @'0*aaC)W?C`h+SJ6@Oץ@'0*E,㷻۩@o@'0*XXts|,IV:n @oץ@'0*gg،<wC|g3{Oi@) 5ۺ@!6aCnCJF@333333@# =p BClustering - 22-Oct-2014 13:42:35?s7>pR22 serialization::archive 11 0 1 1 27 CVChemicalSpaceLayoutEngine 1 0 0 0 0 1.60000000000000000e+001 1.80000000000000000e+002 -1.00000000000000000e+000 -1.00000000000000000e+000 1.00000000000000000e+000 1 0GG<Custom>@`@f@^@Pv@􆨣0<;@@?'COz0@@MDLj[wV@@)fJ@vieB@)4@"Ym MCS Cluster = 11@C@0FpA+V.p@aXY@#n*""$X@-v@g@C~3M4o_`@aXY@#n* MCS Cluster = 12@0@_@4#`u@%N~!@@a׀9K%Gtx*@@~ Kyo\Ƅ@@nI&OɝMJO@@ KMMᝨ?y@:RMT @@ΰzaK V@6?CS\%i@%N~!@@a׀MCS Cluster = 2@[@@@S_@WYO[SHRS_@% W@1\@O2^[N'á@@i_/ A @@ %~MA%[@>GvNAJ$V@5`HD$@@,r|@DQ x@@(u@ݖz2߽@@n3Jƅ[]FXE@@nң|?/@aVaPܳ@@~ =UJ\NL@`@GʛL\xOy@@7dO;uJ@`@~u@ʀP:+D@@n L,Nιplq{q@UosIn=@w@vKݩ6@@c$h 8Mȍ@@~m+HKQGo@p@@@ZZY DL$@@@pJDOrU `L@w@~v.OLӲw"B@`@"3njMT/6@@@b+Kh)Z@@16m@,BXR^@@CIƈ0ۺ@p@nGGNX%E@@@~J rN >3@@`@iG>{@w@>dVrI }cW@𒏙OaoI@@EAJa-HeY@@<B̃mCV7@@%O;1@@J+xN ?/@g@kv,BߌW9C@@kkEJAa@r&d&?@p@ssȜ? Ngm여@`@nO-``H)!yb@@~``ާtbqPEBEv~Qȟ@@__GU.Hoyl@@TT]03Lܣ]G@@aaoI[,[|@**PC3@g@TThDE d@w@IIGW#J)H^] @@TT>SJxsd@@ffzA%\И-@`@00BՠFŋEz]@@TTTCoC6P:vD@@%%DF0DL.g@@HHKl4ބ'x@p@bpMK`1ҽFΡV@`@թLҿjbDp@(@66ǙMTK/(H@@FyxJyb@@TT`bwDd(@@xxIsY/N@@00|8_vNRrC@@IIb$G>H@@<<I%]@)<|h@!ܲx766MCS Cluster = 5@wx߃ L@.{5i@)w@@yyNj0'CQ,:H7@p鉚HI6nZos@`@~g\GJj:M@g@7tB Ucw@@K@̀e6U@`@xh=K,AQL @ffw a`HjC@w@`EKZl@@nnމRHV]ް@w@nll GƒN!J](@`@㷢CrO9p@{@p@@A`OoHXo@@@5jhKe5v,@zKib_G8+@g@O@(@ƛPQG@ػ@@{Avd%m @`@uMksǒҵ@@nppxI EN7M@(@o'Fvo2F@@ccs$,H]IЭ~v@@_PEITUFr@@C@`@f@^@PGvNAJ$V@r ʯ!@E_=005`HD$@ ʯ!@E_=$$,r|@DQ x@ ʯ!@E_=(u@ݖz2߽@ ʯ!@E_=--ң|?/@aVaPܳ@ ʯ!@E_=3Jƅ[]FXE@ ʯ!@E_= =UJ\NL@D^B/@E_=7dO;uJ@d^B/@E_= L,Nιplq{q@^B0@E_=%%UosIn=@(+*_@E_=vKݩ6@H+*_@E_=//c$h 8Mȍ@h+*^@E_=m+HKQGo@wVUy@E_=@@fz@E_=Y DL$@@H+*_@{77v.OLӲw"B@wVUy@{b+Kh)Zjа@{ 16m@,BXR^@ ʯ!@ {GGNX%E@@ ʯ!@ {CIƈ0ۺ@r ʯ!@ {J rN >3@@ ʯ!@ {iG>{@ ʯ!@ {𒏙OaoI@ ʯ!@ {EAJa-HeY@D^B/@ {__<B̃mCV7@T^B/@ {%O;1@d^B/@ {++J+v@􆨣0<;@wVUy@/?'COz0@fz@/..MDLj[wV@ ʯ!@/)fJ@vieB@)9`@!Ė 33 MCS Cluster = 11@Q @0FpA+V.p?-?z\$X@-v@ ʯ!@E_=\\C~3M4o_`?-@?z\ MCS Cluster = 12@|{@` @4#`u@ C@9M}}9K%Gtx*@H+*_@EE_=}} Kyo\Ƅ@(+*_@EE_=I&OɝMJO@^B0@EE_= KMMᝨ?y@t^B/@EE_=:RMT @d^B/@EE_=ggΰzaK V@T^B/@EE_=6?CS\%i@ C@9M11MCS Cluster = 2@0@h^KhOwWCCS0\l@)@"f((ȵ0WBe< vqW@H+*_@/ &"#LL'L{@(+*_@b/''Ō_Fܫ'C @t^B/@/•cI5;^u("jа@b/!! 1>xN ?/@^B0@/kv,BߌW9C@r ʯ!@¢/--EJAa@r&d&?@fz@/BBO-``H)!yb@(+*_@¢/ ާtbqPEBSJxsd@wVUy@E_=[[Ô>Ev~Qȟ@ ʯ!@EE_=00ǙMTK/(H@D^B/@E_=BՠFŋEz]@H+*_@E_=$$B- @ ʯ!@EE_=b$G>H@ ʯ!@E_= FyxJyb@ ʯ!@E_=GU.Hoyl@ ʯ!@EE_= `bwDd(@ ʯ!@E_=OODF0DL.g@^B0@E_= zA%\И-@h+*^@E_=E4kE̠9=&@($@!4&ـddMCS Cluster = 4@I@x߃ L@.{5i@!&@B))qO؈3cʡV@T^B/@E_=C)W?C`h+SJ6@D^B/@E_=ts|,IV:n @!&@B33MCS Cluster = 5@4@t92H(;WP#@M@0}'22A3./r9JVX|@M@0}'MCS Cluster = 6@`@e@BgxwAm>w@)%׀@"B@jĀw a`HjC@r ʯ!@/uMksǒҵ@wVUy@¢/ƛPQG@ػ@ ʯ!@¢/))xI EN7M@ ʯ!@¢/++'8AGXh4U@(+*_@/鉚HI6nZos@t^B/@¢/`EKZl@ ʯ!@/ >N!J](@T^B/@/A`OoHXo@d^B/@/4 8JƣY @H+*_@¢/&&7tB Ucw@ ʯ!@/މRHV]ް@r ʯ!@E_= s$,H]IЭ~v@wVUy@/,,㷢CrO9p@{@t^B/@/o'Fvo2F@d^B/@/5jhKe5v,@ ʯ!@E_=.._PEITUFr@ ʯ!@/zKib_G8+@T^B/@¢/++g\GJj:M@ ʯ!@¢/{Avd%m @H+*_@/C@`@f@^@PGvNAJ$V@\}]@e`Ě5`HD$@t\}]@e`Ě,r|@DQ x@*.> @e`Ě(u@ݖz2߽@.> @e`Ěң|?/@aVaPܳ@ .> @e`Ě3Jƅ[]FXE@.> @e`Ě =UJ\NL@.> @e`Ě7dO;uJ@eW@@e`Ě L,Nιplq{q@W@@e`ĚUosIn=@UW@@e`ĚvKݩ6@W@@e`Ěc$h 8Mȍ@EW@@e`Ěm+HKQGo@cqtL@y@bMd@@u&@y@bMdZZY D @y@bMdX[rgJ`C9*s@.> @y@bMd؞a0Kf<&@ .> @y@bMdYm\HȒ*ɩ!@.> @y@bMd3ӵF!2tN'@.> @y@bMdoF@ɵ(@eW@@y@bMdeO/C%ޕ?@W@@y@bMdFdn̡OpLӮM4@UW@@y@bMdzk?E0@W@@y@bMd&>L$@@EW@@y@bMdv.OLӲw"B@cqtL@X 1&b+Kh)Z@u&@X 1&16m@,BXR^@\}]@X 1&GGNX%E@@t\}]@X 1&CIƈ0ۺ@*.> @X 1&J rN >3@@.> @X 1&iG>{@.> @X 1&𒏙OaoI@.> @X 1&EAJa-HeY@.> @X 1&<B̃mCV7@eW@@X 1&%O;1@W@@X 1&J+ @ 1&ʊCo_uW;@.> @ 1&X;HMS Fi*@ .> @ 1&+|:OF"N@.> @ 1&1_Gz۝\@.> @ 1&𦅀OL-+"XV@.> @ 1&YB Cy;4@eW@@ 1&9wG7S`@W@@ 1&^o*Gr!@UW@@ 1& ܽ (K#ӽlh@W@@ 1&. MrJ9D`@EW@@ 1&ȰmhH˸6 O@cqtL@@Y+MF2Ib@u&@@YFo+DdI%@\}]@@YdNoH[?zC@\}]@@YN}D[r#4@.> @@YL }G{uJb@ .> @@Y_EM(@.> @@YiS N*@.> @@Y2*oL @@Yp8m/D֑$}@W@@@YvD.&KJğ~$@UW@@@Y%+Ng%@W@@@Y3y+_J墢i[g@EW@@@YUg[GZ^~@cqtL@l@YIZGUsꨂ@*a{@" - MCS Cluster = 10@|@@ FpA+V.p@%v@;Qhd""$X@-v@.> @ I,C~3M4o_`@%v@;Qhd MCS Cluster = 11@tލ@@4#`u@$SÈ@eH 9K%Gtx*@eW@@@Y Kyo\Ƅ@*.> @@YI&OɝMJO@t\}]@ 1& KMMᝨ?y@.> @e`Ě:RMT @\}]@X 1&ΰzaK V@.> @y@bMd6?CS\%i@$SÈ@eH MCS Cluster = 2@cxN ?/@EW@@V I,kv,BߌW9C@cqtL@6 I,kkEJAa@r&d&?@u&@6 I,ssO-``H)!yb@\}]@6 I,``ާtbqPEB @6 I,EG9'G93@.> @6 I,+g2KA`vO@ .> @6 I,ww|YEĺI@.> @6 I,!N?GW@@.> @6 I,^^ 8zGޜ @.> @6 I,WWaIN]x'@eW@@6 I,a,Nyz@W@@6 I,\ՋME )@UW@@6 I,kk J@ @W@@6 I, C3\K7҂s1@EW@@6 I,ppyRL_M`-N@cqtL@ I,ccoB5.F\R@u&@ I,6*C}pq,@*`@"7HNMCS Cluster = 3@Y@bpMK`1ҽFΡV@'a@ 33UhDE d@\}]@l@YIIPC3@t\}]@l@YTTIsY/N@*.> @l@Y00>SJxsd@.> @l@YffÔ>Ev~Qȟ@ .> @l@Y__ǙMTK/(H@.> @l@YBՠFŋEz]@.> @l@YTTB- @.> @l@Y<<b$G>H@eW@@l@Y<<FyxJyb@W@@l@YTTGU.Hoyl@UW@@l@YTT`bwDd(@W@@l@YxxDF0DL.g@EW@@l@YHHzA%\И-@cqtL@,@Y00E4kE̠9=&@'a@ 33UrrMCS Cluster = 4@&@@W`x߃ L@.{5i@#ӎH@(RTTqO؈3cʡV@eW@@ I,aaC)W?C`h+SJ6@W@@ I,ts|,IV:n @#ӎH@(RggMCS Cluster = 5@b72H(;WP#@an@<=5QA3./r9JVX|@an@<=5QMCS Cluster = 6@I- @5_BgxwAm>w@*@"^ޟ@yyw a`HjC@\}]@,@YuMksǒҵ@*.> @V I,ppƛPQG@ػ@*.> @,@YxI EN7M@W@@,@Y'8AGXh4U@eW@@,@Y鉚HI6nZos@W@@,@Y`EKZl@ .> @@Ynn>N!J](@ .> @V I,A`OoHXo@EW@@,@Y4 8JƣY @*.> @@Yxx7tB Ucw@\}]@V I,މRHV]ް@u&@@Ylls$,H]IЭ~v@.> @V I,㷢CrO9p@{@ .> @,@Yo'Fvo2F@.> @@Ycc5jhKe5v,@\}]@,@Y_PEITUFr@.> @,@YzKib_G8+@EW@@@Yg\GJj:M@.> @@Y{Avd%m @cqtL@V I,C @,@YffMw@Iڣ^+;@t\}]@V I,O@*@"^ޟMCS Cluster = 7@h@h`n@F݊h@(ZB܀@!kQQuGغaBUO@*.> @ I,G'GHdF@.> @ I,UURk nrRGBlus#@ .> @ I,//E,㷻۩@UW@@ I,XX،<wC|g3{Oi@(ZB܀@!kMCS Cluster = 8@f@@W`+~M%Z4@)l @!4}!G $U@u&Q>vpccJOhQz*}a@\}]Q>vphhLL2FXVn@\}]Q>vpRRPV2&GdF @t\}]Q>vp¹ MʢIr@*.> Q>vpPv.rBD @.> Q>vp&d7IVм]!k@ .> Q>vp~DS-qe﴿@.> Q>vp}}(0Oεt@.> Q>vp,!pqGӅ=5@.> Q>vpQC0dFaJI@eW@Q>vpC]΍OjzV%0@W@Q>vphhOu5L]L@UW@Q>vp * gKK&1%@)l @!4}MCS Cluster = 9@Sh@bt jiS]tF6_@' R@@ 6'3EǤ-\@W@@@YV@2kN9&<+=@.> @V I,||9IE8U1Q@t\}]@@Yy1OUF/<^@\}]@V I,bbAz;@UW@@@YܜOkzg&:@.> @@Y' ANhX)@.> @,@YN>v@􆨣0<;@cqtL@@Y?'COz0@W@@@YMDLj[wV@.> @@Y)fJ@vieB@' R@@ 5aCnCJF@333333@# =p JMCS Clustering - 22-Oct-2014 14:21:59? nr6F(vR22 serialization::archive 11 0 1 1 27 CVChemicalSpaceLayoutEngine 1 0 0 0 0 1.60000000000000000e+001 1.80000000000000000e+002 -1.00000000000000000e+000 -1.00000000000000000e+000 1.00000000000000000e+000 1 0GG<Custom>@`@f@^@PN!J](@)MS@!kEn_PEITUFr@W\.@A3./r9JVX|@)MS@!kEnMCS Cluster = 1@@x\PHo~qLU @'\@ T>3@o}@T*w(p_@ o@nuu %~MA%[@w\.@:RMT @^y@+MF2Ib@ oJ rN >3@@\.@~I&OɝMJO@o@GGNX%E@@g\.@~9K%Gtx*@o@ KMMᝨ?y@o@Fo+DdI%@o Kyo\Ƅ@ o@@4#`u@o@+|:OF"N@\.@n>GvNAJ$V@\.@6?CS\%i@{|ep@EAJa-HeY@o=2]@~ΰzaK V@'\@ T>3@ MCS Cluster = 10@S ( @ Mw@Iڣ^+;@%C<<K@{4 8JƣY @{|ep@xx㷢CrO9p@{@\.@A`OoHXo@s^{|ep@5jhKe5v,@g\.@zKib_G8+@G\.@O@^y@ƛPQG@ػ@o@{Avd%m @o@uMksǒҵ@G\.@ppxI EN7M@o@Cv@􆨣0<;@o@?'COz0@o@2H(;WP#@o@MDLj[wV@ o@)fJ@vieB@&%@ Vpu| MCS Cluster = 13@@YFpA+V.p@) /夠@"HRҝ""$X@-v@o=2]@C~3M4o_`@) /夠@"HRҝMCS Cluster = 2@O7`@KhOwWCCS0\l@) R@"Qȵ0WBe< vqW@O=2]@&"#LL'L{@\.@Ō_Fܫ'C @\.@``•cI5;^u("@w\.@ 1>xN ?/@g\.@kv,BߌW9C@W\.@kkEJAa@r&d&?@G\.@ssO-``H)!yb@o@``ާtbqPEBSJxsd@^y@@ffÔ>Ev~Qȟ@s^{|ep@@__ǙMTK/(H@{|ep@@BՠFŋEz]@o=2]@@TTB- @O=2]@@<<b$G>H@\.@@<<FyxJyb@\.@@TTGU.Hoyl@w\.@@TT`bwDd(@g\.@@xxDF0DL.g@W\.@@HHzA%\И-@G\.@@00E4kE̠9=&@'O@ SGrrMCS Cluster = 4@e@Cx߃ L@.{5i@$az@;!TTqO؈3cʡV@\.@aaC)W?C`h+SJ6@w\.@ts|,IV:n @$az@;!ggMCS Cluster = 5@b@wd]! B+Jm܄ }@)QQ*8`@!=316m@,BXR^@W\.@~ ܽ (K#ӽlh@^y@nIZGUsꨂ@^yX;HMS Fi*@w\.@n9wG7S`@{|ep@nvKݩ6@o@,r|@DQ x@O=2]@؞a0Kf<&@o=2]@v.OLӲw"B@o@~<{S@F@W\.@nYO[SHRS_@G\.@(u@ݖz2߽@o=2]@1_Gz۝\@\.@nYm\HȒ*ɩ!@{|ep@%O;1@s^{|ep@~<ОO0|X@o@nʊCo_uW;@g\.@n. MrJ9D`@ovD.&KJğ~$@O=2] L,Nιplq{q@o@&>L$@@o@~ң|?/@aVaPܳ@{|ep@_EM(@g\.O2^[N'á@W\.@3Jƅ[]FXE@s^{|ep@<B̃mCV7@{|ep@~Fdn̡OpLӮM4@o@~𦅀OL-+"XV@O=2]@n!EfDnAl!}I@o@n3ӵF!2tN'@s^{|ep@^o*Gr!@s^{|ep@nX[rgJ`C9*s@)QQ*8@!=3MCS Cluster = 6@ @uUosIn=@*>~yw@"t;2z`YB Cy;4@o=2]@nȰmhH˸6 O@oi_/ A @g\.@c$h 8Mȍ@o@𒏙OaoI@O=2]@~dNoH[?zC@o5} );OY#m@\.@5`HD$@\.@CIƈ0ۺ@w\.@~eO/C%ޕ?@o@~PFײAʤ.IU@@\.@iS N*@w\.b+Kh)Z@G\.@~ =UJ\NL@^y@3y+_J墢i[g@{|ep7dO;uJ@*>~yw@"t;2z`MCS Cluster = 7@k@u`p8m/D֑$}@)l@"I\%+Ng%@o=2]L }G{uJb@W\.m+HKQGo@G\.@oF@ɵ(@^y@2*oL{@\.@~dK3.3@o@nY Dw@)).[@!$yy鉚HI6nZos@o@g\GJj:M@o@7tB Ucw@o=2]@xh=K,AQL @o@ffw a`HjC@W\.@`EKZl@o@nnމRHV]ް@O=2]@ll Gƒ@`@f@^@P = 1@z@@r@Y DGvNAJ$V@g@n!N?GW@@w@^^&d7IVм]!k@p@~dK3.3@@ KMMᝨ?y@ %~MA%[@` L,Nιplq{q@@xh=K,AQL @(@ff@@`@ZZJ+{@@CL$@@`@v.OLӲw"B@p@@?'COz0@@N>v@􆨣0<;@(@Az;@@{Avd%m @@nOu5L]L@@~EAJa-HeY@@n+|:OF"N@nvD.&KJğ~$@@O2^[N'á@@FAOT6@@%O;1@@@ΰzaK V@@n 1>xN ?/@@UosIn=@g@𒏙OaoI@@:RMT @Ō_Fܫ'C @@``I&OɝMJO@po'Fvo2F@@cc>N!J](O@(@noB5.F\R@`@YB Cy;4@w@'3EǤ-\@w@7tB Ucw@`@`EKZl@@nnjiS]tF6_@g@oF@ɵ(@@9wG7S`@`@@w a`HjC@@6*C}pq,@(@<{S@F@`@@2H(;WP#@@2*oLw@@yy5`HD$@p@EJAa@r&d&?@`@ssJ rN >3@@X[rgJ`C9*s@ B+Jm܄ }@@,r|@DQ x@@@s$,H]IЭ~v@p@3ӵF!2tN'@@ȵ0WBe< vqW@@y1OUF/<^@`@bbp8m/D֑$}@w@<ОO0|X@ȰmhH˸6 O@@3y+_J墢i[g@'8AGXh4U@g@~ X@O@@^^㷢CrO9p@{@@n1_Gz۝\@@@%+Ng%@@X;HMS Fi*@@@^o*Gr!@@+MF2Ib@A`OoHXo@@nV@2kN9&<+=@@||9IE8U1Q@@Mw@Iڣ^+;@`@ni_/ A @@MDLj[wV@@|YEĺI@g@6?CS\%i@w@nm+HKQGo@`@\ՋME )@@kk؞a0Kf<&@@@_PEITUFr@gdNoH[?zC@@16m@,BXR^@g@@•cI5;^u("@@PHo~qLU @QC0dFaJI@@~)fJ@vieB@@ 8zGޜ @@WW Gƒ = 2@ !G $U@) @" ccJOhQz*}a@@~hhLL2FXVn@`@~RRPV2&GdF @@~Pv.rBD @@~~DS-qe﴿@`@~}}(0Oεt@(@~,!pqGӅ=5@@~C]΍OjzV%0@@~hh * gKK&1%@) @" *Cluster member<4> = 3@{bpMK`1ҽFΡV@(@!hDE d@@IIPC3@@TTIsY/N@@00>SJxsd@ffÔ>Ev~Qȟ@g@__ǙMTK/(H@w@BՠFŋEz]@@TTB- @@<<b$G>H@`@<<FyxJyb@@TTGU.Hoyl@@TT`bwDd(@@xxDF0DL.g@p@HHzA%\И-@`@00E4kE̠9=&@(@!rr*Cluster member<4> = 4@@ `n@F݊h@%AN@_{QQFpA+V.p@""uGغaBUO@w@G'GHdF@@UURk nrRGBlus#@@//$X@-v@g@C~3M4o_`@w@x߃ L@.{5i@@TTqO؈3cʡV@@aaC)W?C`h+SJ6@@E,㷻۩@`@XXts|,IV:n @@gg،<wC|g3{Oi@%AN@_{aCnCJF@333333@# =p BClustering - 22-Oct-2014 14:23:52?XgB",x22 serialization::archive 11 0 1 1 27 CVChemicalSpaceLayoutEngine 1 0 0 0 0 1.60000000000000000e+001 1.80000000000000000e+002 -1.00000000000000000e+000 -1.00000000000000000e+000 1.00000000000000000e+000 1 0GG<Custom>@`@f@^@PGvNAJ$V@`5`HD$@@,r|@DQ x@@(u@ݖz2߽@@nң|?/@aVaPܳ@@~3Jƅ[]FXE@(@n =UJ\NL@@7dO;uJ@@~ L,Nιplq{q@(UosIn=@g@vKݩ6@@c$h 8Mȍ@(@~m+HKQGo@`@@@ZZY DL$@@w@v.OLӲw"B@@b+Kh)Z@`@16m@,BXR^@`@GGNX%E@@@~CIƈ0ۺ@@nJ rN >3@@p@iG>{@g@𒏙OaoI@w@EAJa-HeY@p@<B̃mCV7@w@%O;1@@J+V@"815ȵ0WBe< vqW@@&"#LL'L{@@Ō_Fܫ'C @@``•cI5;^u("@(@ 1>xN ?/@kv,BߌW9C@@kkEJAa@r&d&?@@ssO-``H)!yb@g@~``ާtbqPEBV@"815MCS Cluster = 3@Y@bpMK`1ҽFΡV@)#s4@@"+jRhDE d@@IIPC3@`@TTIsY/N@@00>SJxsd@@ffÔ>Ev~Qȟ@@__ǙMTK/(H@p@BՠFŋEz]@`@TTB- @(@<<b$G>H@@<<FyxJyb@@TTGU.Hoyl@@TT`bwDd(@@xxDF0DL.g@HHzA%\И-@g@00E4kE̠9=&@)#s4`@"+jRrrMCS Cluster = 4@&@@W`x߃ L@.{5i@e7@ h}TTqO؈3cʡV@(@aaC)W?C`h+SJ6@@ts|,IV:n @e7@ h}ggMCS Cluster = 5@b72H(;WP#@)H=e@!BA3./r9JVX|@)H=e@!BMCS Cluster = 6@I- @5_BgxwAm>w@)@"EE yyw a`HjC@g@uMksǒҵ@p@nppƛPQG@ػ@@xI EN7M@@'8AGXh4U@`@@鉚HI6nZos@@~`EKZl@@nn>N!J](@@A`OoHXo@@@4 8JƣY @~xx7tB Ucw@@މRHV]ް@g@nlls$,H]IЭ~v@@㷢CrO9p@{@@@o'Fvo2F@@cc5jhKe5v,@g_PEITUFr@@zKib_G8+@g\GJj:M@@{Avd%m @@C!G $U@p@ccJOhQz*}a@`@hhLL2FXVn@(@RRPV2&GdF @@¹ MʢIr@w@~Pv.rBD @@&d7IVм]!k@~DS-qe﴿@@}}(0Oεt@@,!pqGӅ=5@QC0dFaJI@@C]΍OjzV%0@g@hhOu5L]L@@ * gKK&1%@*Cs-HP@"w',:>MCS Cluster = 9@Sh@bt jiS]tF6_@(<k@!CP@'3EǤ-\@(@V@2kN9&<+=@@@||9IE8U1Q@@@y1OUF/<^@@bbAz;@@ܜOkzg&:@`@n' ANhX)@@~N>v@􆨣0<;@`@?'COz0@@MDLj[wV@w@)fJ@vieB@(<k@!CP@aCnCJF@333333@# =p JMCS Clustering - 22-Oct-2014 14:24:06?ߐoLµJ22 serialization::archive 11 0 1 1 27 CVChemicalSpaceLayoutEngine 1 0 0 0 0 1.60000000000000000e+001 1.80000000000000000e+002 -1.00000000000000000e+000 -1.00000000000000000e+000 1.00000000000000000e+000 1 0GG<Custom>@`@f@^@PGvNAJ$V@5`HD$@`,r|@DQ x@(u@ݖz2߽@ң|?/@aVaPܳ@3Jƅ[]FXE@p =UJ\NL@`7dO;uJ@( L,Nιplq{q@UosIn=@vKݩ6@c$h 8Mȍ@m+HKQGo@n@@g@nZZY DL$@@@nv.OLӲw"B@@nb+Kh)Z@~16m@,BXR^@g@~GGNX%E@@w@~CIƈ0ۺ@@~J rN >3@@@~iG>{@`@~𒏙OaoI@@~EAJa-HeY@@~<B̃mCV7@@~%O;1@p@~J+xN ?/@(@kv,BߌW9C@@kkEJAa@r&d&?@@ssO-``H)!yb@@``ާtbqPEBSJxsd@@@ffÔ>Ev~Qȟ@@@__ǙMTK/(H@`@@BՠFŋEz]@@@TTB- @@@<<b$G>H@@@<<FyxJyb@p@@TTGU.Hoyl@`@@TT`bwDd(@(@@xxDF0DL.g@@@HHzA%\И-@@@00E4kE̠9=&@(%!X@!}XZ^@rrMCS Cluster = 4@&@@W`x߃ L@.{5i@5L@[7TTqO؈3cʡV@aaC)W?C`h+SJ6@g@ts|,IV:n @5L@[7ggMCS Cluster = 5@b72H(;WP#@@@9BA3./r9JVX|@@@9BMCS Cluster = 6@I- @5_BgxwAm>w@)`}@!uq/yyw a`HjC@@uMksǒҵ@@ppƛPQG@ػ@@xI EN7M@p@'8AGXh4U@`@鉚HI6nZos@(@`EKZl@@nn>N!J](@@A`OoHXo@@4 8JƣY @@xx7tB Ucw@މRHV]ް@g@lls$,H]IЭ~v@w@㷢CrO9p@{@@o'Fvo2F@@cc5jhKe5v,@`@_PEITUFr@@zKib_G8+@@g\GJj:M@@{Avd%m @p@Cv@􆨣0<;@(@?'COz0@@MDLj[wV@@)fJ@vieB@*DaF쬀@"wmaaCnCJF@333333@# =p JMCS Clustering - 22-Oct-2014 14:24:28?ߝ*aoVߗb`22 serialization::archive 11 0 1 1 27 CVChemicalSpaceLayoutEngine 1 0 0 0 0 1.60000000000000000e+001 1.80000000000000000e+002 -1.00000000000000000e+000 -1.00000000000000000e+000 1.00000000000000000e+000 1 0GG<Custom>@`@f@^@PGvNAJ$V@{y@d'_5`HD$@^L$@@^3@@{y@ iG>{@^xN ?/@^SJxsd@^Ev~Qȟ@^H@^w@(v@!t޼yyw a`HjC@{y@ uMksǒҵ@ox@^ ppƛPQG@ػ@^N!J](@{y@ A`OoHXo@ox@ 4 8JƣY @ox@/xx7tB Ucw@ox@ މRHV]ް@{y@| lls$,H]IЭ~v@Pb0@/㷢CrO9p@{@^v@􆨣0<;@ox@B/?'COz0@ox@/MDLj[wV@^w@v@!@@d_fexi@J!|YEĺI@/24@!G'GHdF@/24@J!BՠFŋEz]@/24@J!Pv.rBD @v/24@B%mT6@4#`u@4_fexi@B%mT6 J@ @/24@B%mT61_Gz۝\@L_fexi@Jڨk㷢CrO9p@{@v/24@!^o*Gr!@4_fexi@B%mT6 =UJ\NL@/24@B%mT6B- @d_fexi@,!ʊCo_uW;@/24@VB%mT6 8zGޜ @4_fexi@J!xh=K,AQL @/24@h!uGغaBUO@v@B%mT6ң|?/@aVaPܳ@/24@8B%mT6Ō_Fܫ'C @4_fexi@Y!qO؈3cʡV@L_fexi@Y!Ug[GZ^~@4_fexi@tB%mT6zk?E0@/24@VB%mT66?CS\%i@v@tB%mT6bpMK`1ҽFΡV@/24@!J rN >3@@v/24@8B%mT67dO;uJ@/24@P(0Oεt@v@8B%mT6O@L_fexi@B%mT6%+Ng%@4_fexi@B%mT6m+HKQGo@L_fexi@B%mT6N>v@􆨣0<;@v/24@B%mT6u 0I<;wq@d_fexi@VB%mT6GGNX%E@@L_fexi@tB%mT6xI EN7M@v@! 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