0 B9R0.56 CC(=O)OCCS(=O)(=O)Cl 1P00G8XG [0,0,0,0,0,0|4,0,0]=4 1 B9R0.56 CC(=O)OCC[N+](C)(C)C 1P006P51 [0,0,0,0,0,0|0,0,0]=0 2 B9R0.56 CC(=O)OCC[N+](C)(C)C 1P00BCV3 [0,0,0,0,0,0|0,0,0]=0 3 B9R0.56 CC(=O)OCC[N+](C)(C)C 1P00E92J [0,0,0,0,0,0|0,0,0]=0 4 B9R0.56 CC(=O)SCC[N+](C)(C)C 1P00E9Y1 [0,0,0,0,0,0|0,1,0]=1 5 B9R0.56 CC(=O)SCC[N+](C)(C)C 1P00I2AL [0,0,0,0,0,0|0,1,0]=1 6 B9R0.56 CC(CCCC(C)(C)C)N 1P027Z9W [0,0,0,0,0,0|3,0,1]=4 7 B9R0.56 ClC(=O)OCC[Si](C)(C)C 1P002E00 [0,0,0,0,0,0|2,0,0]=2 8 B9R0.56 F[B-](CCOC(=O)C)(F)F 1P009F9I [0,0,0,0,0,0|4,0,0]=4 9 B9R0.56 NC(=O)CCNC(C)(C)C 1P01A0I8 [0,0,0,0,0,0|4,0,0]=4 10 B9R0.56 NC(=O)OCC[N+](C)(C)C 1P00DELC [0,0,0,0,0,0|1,0,0]=1 11 B9R0.56 NC(=[NH2+])NCC[N+](C)(C)C 1P01EZK1 [0,0,0,0,0,0|3,0,0]=3 12 B9R0.56 OC(=O)C#CCC(C)(C)C 1P01C47S [0,0,0,0,0,0|3,0,1]=4 13 B9R0.56 OC(=O)CCCC(C)(C)C 1P002OSG [0,0,0,0,0,0|3,0,0]=3 14 B9R0.56 OC(=O)CCC[N+](C)(C)C 1P00EEZK [0,0,0,0,0,0|2,0,0]=2 15 B9R0.56 OC(=O)CCC[Si](C)(C)C 1P00BVS7 [0,0,0,0,0,0|3,0,0]=3 16 B9R0.56 OC(=O)CCNC(C)(C)C 1P019L1G [0,0,0,0,0,0|4,0,0]=4 17 B9R0.56 OC(=O)CCN[N+](C)(C)C 1P00IKXR [0,0,0,0,0,0|3,0,0]=3 18 B9R0.56 OC(=O)CNCC(C)(C)C 1P01B6TR [0,0,0,0,0,0|4,0,0]=4 19 B9R0.56 OC(=O)COCC(C)(C)C 1P028VIS [0,0,0,0,0,0|4,0,0]=4 20 B9R0.56 [O-]C(=O)CCCC(O)(C)C 1P01BBKM [0,0,0,0,0,0|4,0,0]=4 21 B9R0.56 [O-]C(=O)CCN[N+](C)(C)C 1P00GTSJ [0,0,0,0,0,0|3,0,0]=3 22 B8R0.21 CNCCC[Si](C)(C)C 1P027VDI [1,0,0,0,0,0|3,0,0]=4 23 B8R0.21 ClCOCC[Si](C)(C)C 1P0033CN [1,0,0,0,0,0|2,0,1]=4 24 B8R0.21 NCCCC[N+](C)(C)C 1P01AM04 [1,0,0,0,0,0|2,0,1]=4 25 B8R0.21 O=COCCC(S)(C)C 1P003K31 [1,0,0,0,0,0|2,0,0]=3 26 B8R0.21 [N-]=[N+]=NCC[N+](C)(C)C 1P0285LN [1,0,0,0,0,0|3,0,0]=4 27 B8R0.28 CC(=O)CCC=C(C)C 1P003NR6 [1,0,0,0,0,0|2,0,1]=4 28 B8R0.28 CC(=O)CCCC(=O)C 1P00700E [1,0,0,0,0,0|3,0,0]=4 29 B8R0.28 CC(=O)CCOC(=O)C 1P00054J [1,0,0,0,0,0|2,0,0]=3 30 B8R0.28 CC(=O)OCC=C(C)C 1P000INH [1,0,0,0,0,0|1,0,1]=3 31 B8R0.28 CC(=O)OCOC(=O)C 1P0037DI [1,0,0,0,0,0|3,0,0]=4 32 B8R0.28 CC(CCCC(=O)C)C 1P003NRC [1,0,0,0,0,0|2,0,0]=3 33 B8R0.28 CC(CCNC(=O)C)C 1P0038AX [1,0,0,0,0,0|2,0,0]=3 34 B8R0.28 CC(CCNC(=O)N)C 1P00EZOW [1,0,0,0,0,0|3,0,0]=4 35 B8R0.28 CC(CCOC(=O)C)C 1P000KEB [1,0,0,0,0,0|1,0,0]=2 36 B8R0.28 CC(CCOC(=O)Cl)C 1P00EM5G [1,0,0,0,0,0|2,0,0]=3 37 B8R0.28 CC(CCO[N+](=O)[O-])C 1P003RIW [1,0,0,0,0,0|3,0,0]=4 38 B8R0.28 CC(CNCC(=O)C)C 1P01C40Z [1,0,0,0,0,0|3,0,0]=4 39 B8R0.28 CC(CSCC(=O)C)C 1P01AH6M [1,0,0,0,0,0|3,0,0]=4 40 B8R0.28 CN(CCCC(=O)C)C 1P00C0OS [1,0,0,0,0,0|1,0,1]=3 41 B8R0.28 CN(CCCC(=O)Cl)C 1P01BAO9 [1,0,0,0,0,0|2,0,1]=4 42 B8R0.28 CN(CCCC(=O)O)C 1P0034HC [1,0,0,0,0,0|2,0,1]=4 43 B8R0.28 CN(CCCC(=O)O)C 1P0034HD [1,0,0,0,0,0|2,0,1]=4 44 B8R0.28 CN(CCNC(=O)N)C 1P01ANES [1,0,0,0,0,0|2,0,1]=4 45 B8R0.28 CN(CCOC(=O)C)C 1P001I9K [1,0,0,0,0,0|0,0,1]=2 46 B8R0.28 OC(=O)CCOC(=O)C 1P019UFL [1,0,0,0,0,0|3,0,0]=4 47 B10R0.12 CC(=O)OCC(=O)C(C)(C)C 1P01B268 [0,1,0,0,0,0|1,0,1]=3 48 B10R0.12 CC(=O)SCC([N+](C)(C)C)C 1P01BABO [0,1,0,0,0,0|0,1,0]=2 49 B10R0.12 OC(C(C)(C)C)CCC(=O)[O-] 1P01FIB0 [0,1,0,0,0,0|3,0,0]=4 50 B10R0.31 CC(CC(C)(C)C)CC(=O)C 1P00D6RC [0,1,0,0,0,0|2,0,0]=3 51 B10R0.31 CC(CC(C)(C)C)CC(=O)Cl 1P003J0A [0,1,0,0,0,0|3,0,0]=4 52 B10R0.31 CC(CC(C)(C)C)CC(=O)N 1P01AVFT [0,1,0,0,0,0|3,0,0]=4 53 B10R0.31 CC(CC(C)(C)C)CC(=O)O 1P003J09 [0,1,0,0,0,0|3,0,0]=4 54 B10R0.31 CC(CC(O)(C)C)OC(=O)C 1P024HTG [0,1,0,0,0,0|2,0,0]=3 55 B10R0.31 CC(C[N+](C)(C)C)OC(=O)C 1P003RY7 [0,1,0,0,0,0|0,0,0]=1 56 B10R0.31 CC(C[N+](C)(C)C)OC(=O)C 1P00BYQ2 [0,1,0,0,0,0|0,0,0]=1 57 B10R0.31 CC(C[N+](C)(C)C)OC(=O)N 1P00IAY5 [0,1,0,0,0,0|1,0,0]=2 58 B10R0.31 NC(CC(C)(C)C)CC(=O)O 1P01AD2M [0,1,0,0,0,0|3,0,0]=4 59 B10R0.31 OC(=O)C[C@H](C[N+](C)(C)C)O 1P00I7Q6 [0,1,0,0,0,0|2,0,0]=3 60 B10R0.31 OC(=O)C[C@H](C[N+](C)(C)C)O 1P00IGM7 [0,1,0,0,0,0|2,0,0]=3 61 B10R0.31 OC(CC(C)(C)C)CC(=O)O 1P001MCY [0,1,0,0,0,0|3,0,0]=4 62 B10R0.31 OC(C[N+](C)(C)C)CC(=O)[O-] 1P00I90U [0,1,0,0,0,0|2,0,0]=3 63 B10R0.31 OC(C[N+](C)(C)C)CC(=O)[O-] 1P00IA4E [0,1,0,0,0,0|2,0,0]=3 64 B10R0.31 O[C@@H](C[N+](C)(C)C)CC(=O)O 1P003RPA [0,1,0,0,0,0|2,0,0]=3 65 B10R0.31 O[C@H](C[N+](C)(C)C)CC(=O)[O-] 1P00394N [0,1,0,0,0,0|2,0,0]=3 66 B10R0.60 C=CC(=O)OCC[N+](C)(C)C 1P0038AQ [0,1,0,0,0,0|0,0,1]=2 67 B10R0.60 COC(=O)CCN[N+](C)(C)C 1P008ZYE [0,1,0,0,0,0|2,0,0]=3 68 B10R0.60 ClCC(=O)NCCC(C)(C)C 1P019W53 [0,1,0,0,0,0|2,0,0]=3 69 B10R0.60 NNC(=O)OCC[Si](C)(C)C 1P01S7U8 [0,1,0,0,0,0|2,0,0]=3 70 B10R0.65 CCC(CCCC(=O)O)(C)C 1P00DA1Y [0,1,0,0,0,0|3,0,0]=4 71 B10R0.65 COC(CCOC(=O)C)(C)C 1P003K3H [0,1,0,0,0,0|1,0,0]=2 72 B10R0.65 OCC(CCCC(=O)C)(C)C 1P01C5NW [0,1,0,0,0,0|2,0,0]=3 73 B10R0.92 CC(C(=O)O)CCC(C)(C)C 1P01A7HW [0,1,0,0,0,0|3,0,0]=4 74 B10R0.92 FC(C(=O)O)CCC(C)(C)C 1P027U9Q [0,1,0,0,0,0|3,0,0]=4 75 B10R0.92 NC(C(=O)N)CCC(C)(C)C 1P01BFVJ [0,1,0,0,0,0|3,0,0]=4 76 B10R0.92 NC(C(=O)O)CCC(C)(C)C 1P01A7GS [0,1,0,0,0,0|3,0,0]=4 77 B10R0.92 NC(C(=O)O)CCC(C)(C)C 1P01BEQG [0,1,0,0,0,0|3,0,0]=4 78 B10R0.92 N[C@@H](C(=O)O)CCC(C)(C)C 1P00HX6S [0,1,0,0,0,0|3,0,0]=4 79 B10R0.92 N[C@H](C(=O)O)CCC(C)(C)C 1P01JN5H [0,1,0,0,0,0|3,0,0]=4 80 B10R0.92 O=C(C(=O)O)CCC(C)(C)C 1P01BI6F [0,1,0,0,0,0|3,0,0]=4 81 B10R0.113 CC(CCOS(=O)(=O)C)(C)C 1P01B9BD [0,1,0,0,0,0|2,0,0]=3 82 B10R0.113 CC(CCOS(=O)(=O)C)(O)C 1P019TEQ [0,1,0,0,0,0|3,0,0]=4 83 B10R0.113 C[N+](CCCS(=O)(=O)[O-])(C)C 1P00CBY4 [0,1,0,0,0,0|3,0,0]=4 84 B10R0.113 OP(=O)(OCC[N+](C)(C)C)O 1P001YXC [0,1,0,0,0,0|2,0,0]=3 85 B10R0.113 OP(=O)(OCC[N+](C)(C)C)O 1P0039Y1 [0,1,0,0,0,0|2,0,0]=3 86 B10R0.113 OP(=O)(OCC[N+](C)(C)C)O 1P01K9EX [0,1,0,0,0,0|2,0,0]=3 87 B10R0.113 [O-]P(=O)(OCC[N+](C)(C)C)[O-] 1P00DEIT [0,1,0,0,0,0|2,0,0]=3 88 B10R0.113 [O-]P(=O)(OCC[N+](C)(C)C)[O-] 1P00FDY3 [0,1,0,0,0,0|2,0,0]=3 89 B10R1.55 CC(C1CCC(=O)O1)(C)C 1P01EI82 [0,0,0,1,0,0|3,0,0]=4 90 B10R1.55 CC(C1COC(=O)N1)(C)C 1P019TA7 [0,0,0,1,0,0|2,0,0]=3 91 B10R1.55 CC(C1OCC(=O)C1)(C)C 1P02862P [0,0,0,1,0,0|3,0,0]=4 92 B10R1.55 CC(C1SCC(=O)C1)(C)C 1P01BE9G [0,0,0,1,0,0|3,0,0]=4 93 B10R1.55 CC([C@@H]1COC(=O)N1)(C)C 1P007LF4 [0,0,0,1,0,0|2,0,0]=3 94 B10R1.55 CC([C@H]1COC(=O)N1)(C)C 1P00IA8J [0,0,0,1,0,0|2,0,0]=3 95 B10R1.55 O=C1CCC(C1)P(=O)(C)C 1P028LB7 [0,0,0,1,0,0|2,1,0]=4 96 B10R1.55 O=C1CCN(C1)C(C)(C)C 1P028G4K [0,0,0,1,0,0|3,0,0]=4 97 B10R1.55 O=C1NCC(C1)C(C)(C)C 1P004ZWY [0,0,0,1,0,0|2,0,0]=3 98 B10R1.55 O=C1OCC(C1)P(=O)(C)C 1P028VEB [0,0,0,1,0,0|1,1,0]=3 99 B10R1.112 CC(CC1CC(=O)C1)(C)C 1P028UF0 [0,0,0,1,0,0|2,0,0]=3 100 B10R1.112 CC(OC1CC(=O)C1)(C)C 1P01A5SG [0,0,0,1,0,0|3,0,0]=4 101 B10R1.112 O=C1CC(C1)C[Si](C)(C)C 1P028R91 [0,0,0,1,0,0|2,0,0]=3 102 B10R1.302 O=C1CCCC(CC1)(C)C 1P01ALFI [0,0,0,1,0,0|2,0,0]=3 103 B10R1.302 O=C1NCCC(CC1)(C)C 1P01ALF5 [0,0,0,1,0,0|2,0,0]=3 104 B10R1.302 O=C1NCCC(CC1)(C)C 1P028VVT [0,0,0,1,0,0|2,0,0]=3 105 B10R1.302 O=C1OCCC(CC1)(C)C 1P024HML [0,0,0,1,0,0|1,0,0]=2 106 B10R1.350 OC(=O)CCCC1(C)CC1 1P00CMSL [0,0,0,1,0,0|3,0,0]=4 107 B10R1.352 OC(=O)CCC1CC1(C)C 1P01BKTX [0,0,0,1,0,0|3,0,0]=4 108 B10R1.359 OC(=O)C1CCC(C1)(C)C 1P00FPV7 [0,0,0,1,0,0|3,0,0]=4 109 B10R1.359 OC(=O)C1CC[Si](C1)(C)C 1P01XLPX [0,0,0,1,0,0|3,0,0]=4 110 B10R1.371 OC(=O)CC1CC(C1)(C)C 1P01ALVK [0,0,0,1,0,0|3,0,0]=4 111 B8R0.29 CC(=CCC(C)(C)C)C 1P0039LQ [0,0,0,0,1,0|2,0,1]=4 112 B8R0.29 CC(=CC[Si](C)(C)C)C 1P0024R2 [0,0,0,0,1,0|2,0,1]=4 113 B8R0.29 CC(=O)C#C[Si](C)(C)C 1P003KT1 [0,0,0,0,1,0|1,0,2]=4 114 B8R0.29 CC(=O)CCC(C)(C)C 1P007L85 [0,0,0,0,1,0|1,0,0]=2 115 B8R0.29 CC(=O)CCC(O)(C)C 1P00743F [0,0,0,0,1,0|2,0,0]=3 116 B8R0.29 CC(=O)CCP(=O)(C)C 1P028OE3 [0,0,0,0,1,0|1,1,0]=3 117 B8R0.29 CC(=O)CCS(=O)(=O)C 1P006EOH [0,0,0,0,1,0|3,0,0]=4 118 B8R0.29 CC(=O)COC(C)(C)C 1P01HOW4 [0,0,0,0,1,0|2,0,0]=3 119 B8R0.29 CC(=O)CSC(C)(C)C 1P01ABIT [0,0,0,0,1,0|2,0,0]=3 120 B8R0.29 CC(=O)NCC(O)(C)C 1P01BBLR [0,0,0,0,1,0|3,0,0]=4 121 B8R0.29 CC(=O)OC[Si](C)(C)C 1P002Y0U [0,0,0,0,1,0|1,0,0]=2 122 B8R0.29 CC(=O)ONC(C)(C)C 1P003TW7 [0,0,0,0,1,0|2,0,0]=3 123 B8R0.29 CC(=O)SCC(C)(C)C 1P01BGOZ [0,0,0,0,1,0|1,1,0]=3 124 B8R0.29 CC(CCC(C)(C)C)N 1P01AK1V [0,0,0,0,1,0|2,0,1]=4 125 B8R0.29 ClC(=O)COC(C)(C)C 1P01BARD [0,0,0,0,1,0|3,0,0]=4 126 B8R0.29 ClC(=O)OCC(C)(C)C 1P0029RG [0,0,0,0,1,0|2,0,0]=3 127 B8R0.29 NC(=N)CCC(C)(C)C 1P028NFX [0,0,0,0,1,0|3,0,0]=4 128 B8R0.29 NC(=O)CNC(C)(C)C 1P019ZGZ [0,0,0,0,1,0|3,0,0]=4 129 B8R0.29 NC(=O)NCC(C)(C)C 1P019U5E [0,0,0,0,1,0|3,0,0]=4 130 B8R0.29 OC(=O)CCC(C)(C)C 1P008SUK [0,0,0,0,1,0|2,0,0]=3 131 B8R0.29 OC(=O)CCC(F)(C)C 1P028N2G [0,0,0,0,1,0|3,0,0]=4 132 B8R0.29 OC(=O)CCC(N)(C)C 1P00J22H [0,0,0,0,1,0|3,0,0]=4 133 B8R0.29 OC(=O)CCC(S)(C)C 1P009D4O [0,0,0,0,1,0|3,0,0]=4 134 B8R0.29 OC(=O)CCP(=O)(C)C 1P028OK0 [0,0,0,0,1,0|2,1,0]=4 135 B8R0.29 OC(=O)CC[N+](C)(C)C 1P007RMM [0,0,0,0,1,0|1,0,0]=2 136 B8R0.29 OC(=O)CC[Si](C)(C)C 1P00EB1H [0,0,0,0,1,0|2,0,0]=3 137 B8R0.29 OC(=O)CNC(C)(C)C 1P003TTH [0,0,0,0,1,0|3,0,0]=4 138 B8R0.29 OC(=O)CNC(C)(C)C 1P00E9LM [0,0,0,0,1,0|3,0,0]=4 139 B8R0.29 OC(=O)COC(C)(C)C 1P0010OW [0,0,0,0,1,0|3,0,0]=4 140 B8R0.29 OC(=O)CSC(C)(C)C 1P00BFTV [0,0,0,0,1,0|3,0,0]=4 141 B8R0.29 [O-]C(=O)CCC(O)(C)C 1P01ADH8 [0,0,0,0,1,0|3,0,0]=4 142 B8R0.29 [O-][N+](=O)CCC(C)(C)C 1P01EJ2M [0,0,0,0,1,0|3,0,0]=4 143 B10R0.15 OC(=O)CCCCC(C)(C)C 1P00AQ9J [0,0,0,0,0,1|3,0,0]=4 144 B10R0.15 OC(=O)CCCC[N+](C)(C)C 1P004UJD [0,0,0,0,0,1|2,0,0]=3 145 B10R0.15 OC(=O)CCCOC(C)(C)C 1P01BAP8 [0,0,0,0,0,1|3,0,0]=4 146 B10R0.15 OC(=O)CCCSC(C)(C)C 1P01A271 [0,0,0,0,0,1|3,0,0]=4 147 B10R0.15 OC(=O)CCOCC(C)(C)C 1P028USM [0,0,0,0,0,1|3,0,0]=4 148 B10R0.15 [O-]C(=O)CCCC[N+](C)(C)C 1P01FHXT [0,0,0,0,0,1|2,0,0]=3 149 B7R0.4 CC#CCOC(=O)C 1P003P1Q [2,0,0,0,0,0|1,0,1]=4 150 B7R0.4 CC(=O)OCCC=C 1P001Q0I [2,0,0,0,0,0|1,0,1]=4 151 B7R0.4 CC(=O)OCCCCl 1P003JS4 [2,0,0,0,0,0|2,0,0]=4 152 B7R0.4 CC(=O)OCCCI 1P00EKA4 [2,0,0,0,0,0|2,0,0]=4 153 B7R0.4 CC(CCON=O)C 1P0038PB [2,0,0,0,0,0|2,0,0]=4 154 B7R0.4 CCCCCC(=O)C 1P0033SO [2,0,0,0,0,0|2,0,0]=4 155 B7R0.4 CCCCNC(=O)C 1P007VII [2,0,0,0,0,0|2,0,0]=4 156 B7R0.4 CCCCOC(=O)C 1P000KEE [2,0,0,0,0,0|1,0,0]=3 157 B7R0.4 CCCCOC(=O)N 1P003TBD [2,0,0,0,0,0|2,0,0]=4 158 B7R0.4 CCCCSC(=O)C 1P003UQS [2,0,0,0,0,0|1,1,0]=4 159 B7R0.4 CCOCCN(C)C 1P002T4E [2,0,0,0,0,0|0,0,2]=4 160 B7R0.4 CNCCNC(=O)C 1P01A2SE [2,0,0,0,0,0|1,0,1]=4 161 B7R0.4 CNCCNC(=O)C 1P01AF4E [2,0,0,0,0,0|1,0,1]=4 162 B7R0.4 COCCCC(=O)C 1P00B6HE [2,0,0,0,0,0|2,0,0]=4 163 B7R0.4 COCCOC(=O)Cl 1P003I0T [2,0,0,0,0,0|2,0,0]=4 164 B7R0.4 C\C=C\COC(=O)C 1P005DY1 [2,0,0,0,0,0|1,0,1]=4 165 B7R0.8 BrCCC[N+](C)(C)C 1P003C89 [2,0,0,0,0,0|1,0,1]=4 166 B7R0.8 C=CCC[Si](C)(C)C 1P0056V9 [2,0,0,0,0,0|1,0,1]=4 167 B7R0.8 CCCC[N+](C)(C)C 1P002TXM [2,0,0,0,0,0|0,0,1]=3 168 B7R0.8 CCCC[N+](C)(C)C 1P003P33 [2,0,0,0,0,0|0,0,1]=3 169 B7R0.8 CNCCC(C)(C)C 1P009AKY [2,0,0,0,0,0|2,0,0]=4 170 B7R0.8 COCCC(N)(C)C 1P019TZ9 [2,0,0,0,0,0|2,0,0]=4 171 B7R0.8 COCCC(N)(C)C 1P01AC34 [2,0,0,0,0,0|2,0,0]=4 172 B7R0.8 CONCC(C)(C)C 1P01B9X5 [2,0,0,0,0,0|2,0,0]=4 173 B7R0.8 NCCC[N+](C)(C)C 1P01AGHP [2,0,0,0,0,0|1,0,1]=4 174 B7R0.8 NCCC[N+](C)(C)C 1P01AGKP [2,0,0,0,0,0|1,0,1]=4 175 B7R0.8 NOCCC(C)(C)C 1P01ALKR [2,0,0,0,0,0|2,0,0]=4 176 B7R0.8 NOCC[Si](C)(C)C 1P003TVJ [2,0,0,0,0,0|2,0,0]=4 177 B7R0.8 O=CCCC(C)(C)C 1P01BEEG [2,0,0,0,0,0|1,0,0]=3 178 B7R0.8 O=CCOC(C)(C)C 1P020L8E [2,0,0,0,0,0|2,0,0]=4 179 B7R0.8 O=CCSC(C)(C)C 1P0052GW [2,0,0,0,0,0|2,0,0]=4 180 B9R0.38 BrCCCCC[N+](C)(C)C 1P001MRJ [1,1,0,0,0,0|1,0,1]=4 181 B9R0.38 CCCCCC[N+](C)(C)C 1P002TXL [1,1,0,0,0,0|1,0,1]=4 182 B9R0.44 O=CCC(CC(C)(C)C)C 1P003J08 [1,1,0,0,0,0|2,0,0]=4 183 B9R0.1 C=CC(=O)OCCC(C)C 1P003O5G [1,1,0,0,0,0|1,0,1]=4 184 B9R0.1 CCC(=O)CCCC(C)C 1P00E8YX [1,1,0,0,0,0|2,0,0]=4 185 B9R0.1 CCC(=O)OCCC(C)C 1P003RIZ [1,1,0,0,0,0|1,0,0]=3 186 B9R0.1 CCC(=O)OCCN(C)C 1P002VOH [1,1,0,0,0,0|0,0,1]=3 187 B9R0.1 COC(CCOC(=O)C)C 1P00I8VE [1,1,0,0,0,0|1,0,0]=3 188 B9R0.1 ClCC(=O)NCCN(C)C 1P01A8RV [1,1,0,0,0,0|1,0,1]=4 189 B9R0.1 OCC(=O)OCCN(C)C 1P028SZW [1,1,0,0,0,0|0,0,1]=3 190 B9R0.53 CC(CC(CC(=O)C)C)C 1P003832 [1,1,0,0,0,0|2,0,0]=4 191 B9R0.53 CC(OC(=O)Cl)CC(C)C 1P004QZ9 [1,1,0,0,0,0|2,0,0]=4 192 B9R0.10 CC(=O)CC(=O)C(C)(C)C 1P003FS1 [0,1,0,0,1,0|1,0,1]=4 193 B9R0.10 CC(C(C)(C)C)CC(=O)O 1P005EAO [0,1,0,0,1,0|2,0,0]=4 194 B9R0.10 CS(=O)CC(C(C)(C)C)N 1P028K4K [0,1,0,0,1,0|2,0,0]=4 195 B9R0.10 NC(C(C)(C)C)CC(=O)O 1P0029SO [0,1,0,0,1,0|2,0,0]=4 196 B9R0.10 N[C@@H](C(C)(C)C)CC(=O)O 1P00398I [0,1,0,0,1,0|2,0,0]=4 197 B9R0.10 N[C@@H](C(C)(C)C)CC(=O)O 1P01FIWX [0,1,0,0,1,0|2,0,0]=4 198 B9R0.10 N[C@H](C(C)(C)C)CC(=O)O 1P0037RQ [0,1,0,0,1,0|2,0,0]=4 199 B9R0.10 O[C@@H](C(C)(C)C)CC(=O)O 1P004KC6 [0,1,0,0,1,0|2,0,0]=4 200 B9R0.10 O[C@H](C(C)(C)C)CC(=O)O 1P028MFQ [0,1,0,0,1,0|2,0,0]=4 201 B9R0.57 CC(C(=O)O)CC(C)(C)C 1P01ADOK [0,1,0,0,1,0|2,0,0]=4 202 B9R0.57 FC(C(=O)O)CC(C)(C)C 1P027UGQ [0,1,0,0,1,0|2,0,0]=4 203 B9R0.57 NC(C(=O)O)CC(C)(C)C 1P00E9L2 [0,1,0,0,1,0|2,0,0]=4 204 B9R0.57 NC(C(=O)O)CC(C)(C)C 1P01A2A3 [0,1,0,0,1,0|2,0,0]=4 205 B9R0.57 NC(C(=O)O)C[Si](C)(C)C 1P028409 [0,1,0,0,1,0|2,0,0]=4 206 B9R0.57 N[C@@H](C(=O)O)CC(C)(C)C 1P0032VI [0,1,0,0,1,0|2,0,0]=4 207 B9R0.57 N[C@H](C(=O)O)CC(C)(C)C 1P003D1J [0,1,0,0,1,0|2,0,0]=4 208 B9R0.57 N[C@H](C(=O)O)CC(C)(C)C 1P0286IT [0,1,0,0,1,0|2,0,0]=4 209 B9R0.57 O=C(O)[C@@H](N)C[Si](C)(C)C 1P01KHLD [0,1,0,0,1,0|2,0,0]=4 210 B9R0.57 OC(C(=O)O)CC(C)(C)C 1P006TTC [0,1,0,0,1,0|2,0,0]=4 211 B9R0.64 BrCC(CCC(=O)O)(C)C 1P0281H6 [0,1,0,0,1,0|2,0,0]=4 212 B9R0.64 COC(CCC(=O)O)(C)C 1P0288Q5 [0,1,0,0,1,0|2,0,0]=4 213 B9R0.64 OCC(CCC(=O)[O-])(C)C 1P028FHB [0,1,0,0,1,0|2,0,0]=4 214 B9R0.77 CC(COS(=O)(=O)C)(C)C 1P001V7S [0,1,0,0,1,0|2,0,0]=4 215 B9R0.77 C[Si](CCS(=O)(=N)C)(C)C 1P028V4M [0,1,0,0,1,0|2,0,0]=4 216 B11R0.34 C=C(C[Si](C)(C)C)COC(=O)C 1P008RFW [0,1,0,0,0,1|1,0,0]=3 217 B11R0.34 OC(C[N+](C)(C)C)CCC(=O)[O-] 1P028LHY [0,1,0,0,0,1|2,0,0]=4 218 B11R0.114 C=CC(=O)NCCC[N+](C)(C)C 1P003BEV [0,1,0,0,0,1|1,0,1]=4 219 B11R0.199 CC(OCCOS(=O)(=O)C)(C)C 1P00BJMS [0,1,0,0,0,1|2,0,0]=4 220 B11R0.318 CC(=C)C(=O)OCC[N+](C)(C)C 1P006GBT [0,1,0,0,0,1|1,0,0]=3 221 B11R0.318 CC(=C)C(=O)OCC[N+](C)(C)C 1P00I9IF [0,1,0,0,0,1|1,0,0]=3 222 B11R0.119 CC(C)(C)CC(C)CC(OC)=O 1P01KCHH [0,2,0,0,0,0|2,0,0]=4 223 B11R0.180 CCCC(=O)OCC[N+](C)(C)C 1P002QEC [0,2,0,0,0,0|0,0,0]=2 224 B11R0.180 CCCC(=O)OCC[N+](C)(C)C 1P002ZES [0,2,0,0,0,0|0,0,0]=2 225 B11R0.180 CCCC(=O)SCC[N+](C)(C)C 1P007SQA [0,2,0,0,0,0|0,1,0]=3 226 B11R0.180 CCOC(=O)CCCC(C)(C)C 1P01CAT9 [0,2,0,0,0,0|2,0,0]=4 227 B11R0.290 COC(=O)C(CCC(C)(C)C)O 1P01B8PM [0,2,0,0,0,0|2,0,0]=4 228 B9R1.66 O=C1CCCC(C1)(C)C 1P0032R4 [1,0,0,1,0,0|2,0,0]=4 229 B9R1.66 O=C1NCCC(C1)(C)C 1P00E59D [1,0,0,1,0,0|2,0,0]=4 230 B9R1.66 O=C1OCCC(C1)(C)O 1P003LZ1 [1,0,0,1,0,0|2,0,0]=4 231 B9R1.68 CC(C1CCC1=O)(C)C 1P00E09F [1,0,0,1,0,0|2,0,0]=4 232 B9R1.87 O=CC1CC1C(C)(C)C 1P01BV4J [1,0,0,1,0,0|2,0,0]=4 233 B9R1.133 O=CC1CCC(C1)(C)C 1P0284HP [1,0,0,1,0,0|2,0,0]=4 234 B9R1.133 O=CC1CC[Si](C1)(C)C 1P0287YJ [1,0,0,1,0,0|2,0,0]=4 235 B9R1.136 O=CCC1CC(C1)(C)C 1P0209AW [1,0,0,1,0,0|2,0,0]=4 236 B9R1.35 CC(C1COC(=O)N1)C 1P018SII [1,0,0,1,0,0|2,0,0]=4 237 B9R1.35 CC([C@@H]1COC(=O)N1)C 1P003CDG [1,0,0,1,0,0|2,0,0]=4 238 B9R1.35 CC([C@H]1COC(=O)N1)C 1P003CDP [1,0,0,1,0,0|2,0,0]=4 239 B9R1.35 O=C1CCC(C1)C(C)C 1P0090HJ [1,0,0,1,0,0|2,0,0]=4 240 B9R1.35 O=C1NCC(C1)C(C)C 1P00K0B2 [1,0,0,1,0,0|2,0,0]=4 241 B9R1.35 O=C1OCC(C1)C(=O)C 1P008PT7 [1,0,0,1,0,0|2,0,0]=4 242 B9R1.49 CC1CCCC(=O)CC1 1P01ALFG [1,0,0,1,0,0|2,0,0]=4 243 B9R1.49 CC1CCNC(=O)CC1 1P00C2C9 [1,0,0,1,0,0|2,0,0]=4 244 B9R1.49 CN1CCCC(=O)CC1 1P002C56 [1,0,0,1,0,0|1,0,1]=4 245 B9R1.49 CN1CCCC(=O)CC1 1P00ACFT [1,0,0,1,0,0|1,0,1]=4 246 B9R1.49 CN1CCNC(=O)CC1 1P003EYW [1,0,0,1,0,0|1,0,1]=4 247 B9R1.49 CN1CCNC(=O)CC1 1P004NP3 [1,0,0,1,0,0|1,0,1]=4 248 B9R1.53 CC(CC1CC(=O)C1)C 1P020KT8 [1,0,0,1,0,0|2,0,0]=4 249 B9R1.53 O=C1CC(C1)OC(=O)C 1P00391A [1,0,0,1,0,0|2,0,0]=4 250 B9R1.53 O[C@@H]1C[C@@H](C1)OC(=O)C 1P01RBXF [1,0,0,1,0,0|2,0,0]=4 251 B9R1.53 O[C@@H]1C[C@H](C1)OC(=O)C 1P01KAFH [1,0,0,1,0,0|2,0,0]=4 252 B9R1.10 C=C1CCC(CC1)(C)C 1P00IWYP [0,0,0,1,1,0|2,0,0]=4 253 B9R1.10 O=C1CCC(CC1)(C)C 1P00C0Q5 [0,0,0,1,1,0|1,0,0]=3 254 B9R1.10 O=C1CCC(CC1)(C)F 1P005EY9 [0,0,0,1,1,0|2,0,0]=4 255 B9R1.10 O=C1CCC(CC1)(C)N 1P01XAJQ [0,0,0,1,1,0|2,0,0]=4 256 B9R1.10 O=C1CCC(CC1)(C)O 1P0039LN [0,0,0,1,1,0|2,0,0]=4 257 B9R1.10 O=C1CCC(CN1)(C)C 1P00I8BC [0,0,0,1,1,0|2,0,0]=4 258 B9R1.10 O=C1CCP(=O)(CC1)C 1P028JBQ [0,0,0,1,1,0|1,1,0]=4 259 B9R1.10 O=C1CC[N+](CC1)(C)C 1P007N2V [0,0,0,1,1,0|0,0,0]=2 260 B9R1.10 O=C1OCC(CO1)(C)C 1P0034ML [0,0,0,1,1,0|2,0,0]=4 261 B9R1.51 CC(C1CC(=C)C1)(C)C 1P027WZQ [0,0,0,1,1,0|2,0,0]=4 262 B9R1.51 CC(C1CC(=O)C1)(C)C 1P00ILN8 [0,0,0,1,1,0|1,0,0]=3 263 B9R1.51 O=C1CC(C1)[Si](C)(C)C 1P01IOIX [0,0,0,1,1,0|1,0,0]=3 264 B9R1.147 OC(=O)CCC1(C)CC1 1P004JGG [0,0,0,1,1,0|2,0,0]=4 265 B9R1.164 CC(=O)C1CC(C1)(C)C 1P018I1Z [0,0,0,1,1,0|1,0,0]=3 266 B9R1.164 OC(=O)C1CC(C1)(C)C 1P0038ID [0,0,0,1,1,0|2,0,0]=4 267 B11R1.76 O=C1CCC(C1)CC(C)(C)C 1P027U34 [0,0,0,1,0,1|2,0,0]=4 268 B11R1.76 O=C1NCC(C1)CC(C)(C)C 1P01B1XK [0,0,0,1,0,1|2,0,0]=4 269 B11R1.155 CC(C1OCCC(=O)C1)(C)C 1P01BU73 [0,0,0,1,0,1|2,0,0]=4 270 B11R1.155 O=C1NCCC(C1)C(C)(C)C 1P01AGR6 [0,0,0,1,0,1|2,0,0]=4 271 B11R1.730 CC(=O)N1CCNC(C1)(C)C 1P01A51Z [0,0,0,1,0,1|2,0,0]=4 272 B11R1.730 OC(=O)C1OCCC(C1)(C)C 1P027VQ6 [0,0,0,1,0,1|2,0,0]=4 273 B11R1.19 CC(C1CCC(=O)CC1)(C)C 1P006RR1 [0,1,0,1,0,0|2,0,0]=4 274 B11R1.19 CC(C1NCC(=O)NC1)(C)C 1P01CATB [0,1,0,1,0,0|2,0,0]=4 275 B11R1.19 O=C1CCC(CN1)C(C)(C)C 1P01BB9B [0,1,0,1,0,0|2,0,0]=4 276 B11R1.1217 CCC1(C)CCNC(=O)CC1 1P019Z4T [0,1,0,1,0,0|2,0,0]=4 277 B11R2.1796 O=C1CC2(C1)CC(C2)(C)C 1P028HMW [0,0,0,2,0,0|2,0,0]=4 278 B11R2.1077 O=C1CCC(C2C1C2)(C)C 1P004JHS [0,0,0,2,0,0|2,0,0]=4 279 B11R2.1480 O=C1CCCC2(CC1)CC2 1P028UUX [0,0,0,2,0,0|2,0,0]=4 280 B11R2.1480 O=C1NCCC2(CC1)CC2 1P020737 [0,0,0,2,0,0|2,0,0]=4 281 B11R2.1868 CC(=O)C1CCC2(C1)CC2 1P028YRG [0,0,0,2,0,0|2,0,0]=4 282 B7R0.6 CC(=C)CCC(=O)C 1P003NCD [1,0,0,0,1,0|1,0,1]=4 283 B7R0.6 CC(=NOC(=O)C)C 1P01XCOR [1,0,0,0,1,0|2,0,0]=4 284 B7R0.6 CC(=O)CCC(=O)C 1P003GHY [1,0,0,0,1,0|2,0,0]=4 285 B7R0.6 CC(=O)COC(C)C 1P0071XC [1,0,0,0,1,0|2,0,0]=4 286 B7R0.6 CC(=O)OCC(=O)C 1P003IAP [1,0,0,0,1,0|2,0,0]=4 287 B7R0.6 CC(CCC(=O)C)C 1P003NBT [1,0,0,0,1,0|1,0,0]=3 288 B7R0.6 CC(CCC(=O)C)Cl 1P0007YL [1,0,0,0,1,0|2,0,0]=4 289 B7R0.6 CC(CCC(=O)Cl)C 1P003M9S [1,0,0,0,1,0|2,0,0]=4 290 B7R0.6 CC(CCC(=O)N)C 1P007DVM [1,0,0,0,1,0|2,0,0]=4 291 B7R0.6 CC(CCC(=O)O)C 1P003M9R [1,0,0,0,1,0|2,0,0]=4 292 B7R0.6 CC(NCC(=O)C)C 1P01ANL3 [1,0,0,0,1,0|2,0,0]=4 293 B7R0.6 CN(CCC(=O)C)C 1P00C2GG [1,0,0,0,1,0|0,0,1]=3 294 B7R0.6 CN(CCC(=O)C)C 1P00J3Y6 [1,0,0,0,1,0|0,0,1]=3 295 B7R0.6 CN(CCC(=O)Cl)C 1P00GYU2 [1,0,0,0,1,0|1,0,1]=4 296 B7R0.6 CN(CCC(=O)N)C 1P002DMK [1,0,0,0,1,0|1,0,1]=4 297 B7R0.6 CN(CCC(=O)O)C 1P001FQ6 [1,0,0,0,1,0|1,0,1]=4 298 B7R0.6 CN(CCC(=O)O)C 1P00E97T [1,0,0,0,1,0|1,0,1]=4 299 B7R0.6 C[S+](CCC(=O)O)C 1P002KXE [1,0,0,0,1,0|2,0,0]=4 300 B7R0.6 C[S+](CCC(=O)O)C 1P003C35 [1,0,0,0,1,0|2,0,0]=4 301 B7R0.6 C[S+](CCC(=O)[O-])C 1P003Q49 [1,0,0,0,1,0|2,0,0]=4 302 B7R0.9 CC(=C)C[Si](C)(C)C 1P0024QB [0,0,0,0,2,0|2,0,0]=4 303 B7R0.9 CC(=C)O[Si](C)(C)C 1P0027Y7 [0,0,0,0,2,0|2,0,0]=4 304 B7R0.9 CC(=O)CC(C)(C)C 1P003KWI [0,0,0,0,2,0|1,0,0]=3 305 B7R0.9 CC(=O)CC(Cl)(C)C 1P001DU3 [0,0,0,0,2,0|2,0,0]=4 306 B7R0.9 CC(=O)CC(N)(C)C 1P003L6K [0,0,0,0,2,0|2,0,0]=4 307 B7R0.9 CC(=O)CC(O)(C)C 1P000KDW [0,0,0,0,2,0|2,0,0]=4 308 B7R0.9 CC(=O)CC(S)(C)C 1P002C5Z [0,0,0,0,2,0|2,0,0]=4 309 B7R0.9 CC(=O)C[N+](C)(C)C 1P01APWQ [0,0,0,0,2,0|0,0,0]=2 310 B7R0.9 CC(=O)NC(C)(C)C 1P003TTT [0,0,0,0,2,0|2,0,0]=4 311 B7R0.9 CC(=O)N[Si](C)(C)C 1P003SWG [0,0,0,0,2,0|2,0,0]=4 312 B7R0.9 CC(=O)OC(C)(C)C 1P0036K8 [0,0,0,0,2,0|1,0,0]=3 313 B7R0.9 CC(=O)O[Si](C)(C)C 1P002UHX [0,0,0,0,2,0|1,0,0]=3 314 B7R0.9 CC(C[N+](C)(C)C)O 1P002S6A [0,0,0,0,2,0|0,0,2]=4 315 B7R0.9 CC(C[N+](C)(C)C)O 1P003ON0 [0,0,0,0,2,0|0,0,2]=4 316 B7R0.9 ClC(=O)CC(C)(C)C 1P003IU3 [0,0,0,0,2,0|2,0,0]=4 317 B7R0.9 NC(=O)CC(C)(C)C 1P00H1ZB [0,0,0,0,2,0|2,0,0]=4 318 B7R0.9 NC(=O)C[N+](C)(C)C 1P001XEU [0,0,0,0,2,0|1,0,0]=3 319 B7R0.9 NC(=O)OC(C)(C)C 1P00363R [0,0,0,0,2,0|2,0,0]=4 320 B7R0.9 OC(=O)CC(C)(C)C 1P003IU4 [0,0,0,0,2,0|2,0,0]=4 321 B7R0.9 OC(=O)C[N+](C)(C)C 1P00IAY4 [0,0,0,0,2,0|1,0,0]=3 322 B7R0.9 OC(=O)C[Si](C)(C)C 1P002NQR [0,0,0,0,2,0|2,0,0]=4 323 B7R0.9 [O-]C(=O)C[As+](C)(C)C 1P01E6PJ [0,0,0,0,2,0|1,1,0]=4 324 B7R0.9 [O-]C(=O)C[N+](C)(C)C 1P00HBD2 [0,0,0,0,2,0|1,0,0]=3 325 B7R0.9 [O-]C(=O)C[N+](C)(C)C 1P00IAY3 [0,0,0,0,2,0|1,0,0]=3 326 B9R0.55 CC(=O)OCCOC(=O)C 1P003QZ1 [1,0,0,0,0,1|2,0,0]=4 327 B9R0.55 CC(CCOCC(=O)O)C 1P006C8E [1,0,0,0,0,1|2,0,0]=4 328 B9R0.55 CN(CCCCC(=O)C)C 1P01A66E [1,0,0,0,0,1|1,0,1]=4 329 B9R0.55 CN(CCCNC(=O)C)C 1P00I6IQ [1,0,0,0,0,1|1,0,1]=4 330 B9R0.55 CN(CCOCC(=O)O)C 1P01DXED [1,0,0,0,0,1|1,0,1]=4