0 B5R0.1 CCC[C@H](C)N SPC-k309 [1,0,0,0,0,0|1,0,0]=2 1 B5R0.1 C[C@@H](N)CCO SPC-g658 [1,0,0,0,0,0|2,0,0]=3 2 B5R0.1 C[C@H](N)CCO SPC-n760 [1,0,0,0,0,0|2,0,0]=3 3 B5R0.1 NCCC(F)F SPC-w135 [1,0,0,0,0,0|3,0,0]=4 4 B5R0.1 OCCC(F)F SPC-u602 [1,0,0,0,0,0|3,0,0]=4 5 B7R1.1 BrCC1CCCC1 SPC-s715 [0,0,0,1,0,0|1,0,1]=3 6 B7R1.1 BrC[C@H]1CCCO1 SPC-g076 [0,0,0,1,0,0|2,0,1]=4 7 B7R1.1 BrC[C@H]1CCOC1 SPC-h480 [0,0,0,1,0,0|2,0,1]=4 8 B7R1.1 C#C[C@@H]1CCCN1 SPC-p226 [0,0,0,1,0,0|2,0,1]=4 9 B7R1.1 CC[C@@H]1CCNC1 SPC-m807 [0,0,0,1,0,0|2,0,1]=4 10 B7R1.1 CC[C@H]1CCNC1 SPC-m813 [0,0,0,1,0,0|2,0,1]=4 11 B7R1.1 CN[C@@H]1CCOC1 SPC-u441 [0,0,0,1,0,0|3,0,0]=4 12 B7R1.1 CN[C@H]1CCOC1 SPC-j154 [0,0,0,1,0,0|3,0,0]=4 13 B7R1.1 CN[C@H]1CCOC1 SPC-t742 [0,0,0,1,0,0|3,0,0]=4 14 B7R1.1 CO[C@@H]1CCNC1 SPC-h272 [0,0,0,1,0,0|3,0,0]=4 15 B7R1.1 CO[C@H]1CCNC1 SPC-h271 [0,0,0,1,0,0|3,0,0]=4 16 B7R1.1 CO[C@H]1CCNC1 SPC-h273 [0,0,0,1,0,0|3,0,0]=4 17 B7R1.1 FC[C@@H]1CCCN1 SPC-h660 [0,0,0,1,0,0|2,0,1]=4 18 B7R1.1 FC[C@@H]1CCNC1 SPC-v090 [0,0,0,1,0,0|2,0,1]=4 19 B7R1.1 FC[C@H]1CCCN1 SPC-j761 [0,0,0,1,0,0|2,0,1]=4 20 B7R1.1 IC[C@H]1CCOC1 SPC-j340 [0,0,0,1,0,0|2,0,1]=4 21 B7R1.1 N#C[C@@H]1CCCN1 SPC-j755 [0,0,0,1,0,0|2,0,1]=4 22 B7R1.1 N#C[C@@H]1CCCN1 SPC-j756 [0,0,0,1,0,0|2,0,1]=4 23 B7R1.1 N#C[C@@H]1CCNC1 SPC-m809 [0,0,0,1,0,0|2,0,1]=4 24 B7R1.1 N#C[C@@H]1CCOC1 SPC-i063 [0,0,0,1,0,0|2,0,1]=4 25 B7R1.1 N#C[C@H]1CCNC1 SPC-m594 [0,0,0,1,0,0|2,0,1]=4 26 B7R1.1 N#C[C@H]1CCNC1 SPC-n498 [0,0,0,1,0,0|2,0,1]=4 27 B7R1.1 N#C[C@H]1CCOC1 SPC-g788 [0,0,0,1,0,0|2,0,1]=4 28 B7R1.1 NCC1CCCC1 SPC-k191 [0,0,0,1,0,0|1,0,1]=3 29 B7R1.1 NCC1CCCC1 SPC-t893 [0,0,0,1,0,0|1,0,1]=3 30 B7R1.1 NC[C@@H]1CCCN1 SPC-k181 [0,0,0,1,0,0|2,0,1]=4 31 B7R1.1 NC[C@@H]1CCOC1 SPC-j343 [0,0,0,1,0,0|2,0,1]=4 32 B7R1.1 NC[C@@H]1CCOC1 SPC-j344 [0,0,0,1,0,0|2,0,1]=4 33 B7R1.1 NC[C@H]1CCOC1 SPC-g368 [0,0,0,1,0,0|2,0,1]=4 34 B7R1.1 NC[C@H]1CCOC1 SPC-g369 [0,0,0,1,0,0|2,0,1]=4 35 B7R1.1 NC[C@H]1CCOC1 SPC-j341 [0,0,0,1,0,0|2,0,1]=4 36 B7R1.1 OC[C@@H]1CCCN1 SPC-g330 [0,0,0,1,0,0|1,0,2]=4 37 B7R1.1 OC[C@@H]1CCNC1 SPC-k806 [0,0,0,1,0,0|1,0,2]=4 38 B7R1.1 OC[C@@H]1CCNC1 SPC-n751 [0,0,0,1,0,0|1,0,2]=4 39 B7R1.1 OC[C@@H]1CCOC1 SPC-h734 [0,0,0,1,0,0|1,0,2]=4 40 B7R1.1 OC[C@H]1CCCN1 SPC-m785 [0,0,0,1,0,0|1,0,2]=4 41 B7R1.1 OC[C@H]1CCNC1 SPC-k804 [0,0,0,1,0,0|1,0,2]=4 42 B7R1.1 OC[C@H]1CCNC1 SPC-k805 [0,0,0,1,0,0|1,0,2]=4 43 B7R1.1 OC[C@H]1CCNC1 SPC-n768 [0,0,0,1,0,0|1,0,2]=4 44 B7R1.1 OC[C@H]1CCOC1 SPC-j339 [0,0,0,1,0,0|1,0,2]=4 45 B7R1.1 OC[C@H]1CCOC1 SPC-n475 [0,0,0,1,0,0|1,0,2]=4 46 B7R1.2 C[C@@H]1CC[C@@H](C)N1 SPC-s036 [0,0,0,1,0,0|2,0,1]=4 47 B7R1.2 C[C@@H]1C[C@H](O)CN1 SPC-q565 [0,0,0,1,0,0|2,0,1]=4 48 B7R1.2 C[C@H]1CC[C@@H](C)N1 SPC-s037 [0,0,0,1,0,0|2,0,1]=4 49 B7R1.2 C[C@H]1C[C@@H](O)CN1 SPC-r278 [0,0,0,1,0,0|2,0,1]=4 50 B7R1.2 C[C@H]1C[C@H](O)CN1 SPC-n775 [0,0,0,1,0,0|2,0,1]=4 51 B7R1.3 CC1=CCCNC1 SPC-m637 [0,0,0,1,0,0|2,0,1]=4 52 B7R1.3 CC1=CCNCC1 SPC-h455 [0,0,0,1,0,0|2,0,1]=4 53 B7R1.3 C[C@@H]1CNCCN1 SPC-g041 [0,0,0,1,0,0|2,0,1]=4 54 B7R1.3 C[C@@H]1CNCCO1 SPC-n699 [0,0,0,1,0,0|2,0,1]=4 55 B7R1.3 C[C@@H]1COCCN1 SPC-g660 [0,0,0,1,0,0|1,0,2]=4 56 B7R1.3 C[C@H]1CNCCO1 SPC-m798 [0,0,0,1,0,0|2,0,1]=4 57 B7R1.3 C[C@H]1COCCN1 SPC-m696 [0,0,0,1,0,0|1,0,2]=4 58 B7R1.3 F[C@@H]1CCCNC1 SPC-i353 [0,0,0,1,0,0|2,0,1]=4 59 B7R1.3 F[C@H]1CCCNC1 SPC-i164 [0,0,0,1,0,0|2,0,1]=4 60 B7R1.3 F[C@H]1CCCNC1 SPC-j119 [0,0,0,1,0,0|2,0,1]=4 61 B7R1.3 N[C@@H]1CCCOC1 SPC-s681 [0,0,0,1,0,0|1,0,2]=4 62 B7R1.3 N[C@H]1CCCOC1 SPC-n767 [0,0,0,1,0,0|1,0,2]=4 63 B7R1.3 O[C@@H]1CCCNC1 SPC-j185 [0,0,0,1,0,0|2,0,1]=4 64 B7R1.3 O[C@@H]1CCCOC1 SPC-u362 [0,0,0,1,0,0|1,0,2]=4 65 B7R1.3 O[C@H]1CCCNC1 SPC-g006 [0,0,0,1,0,0|2,0,1]=4 66 B7R1.3 O[C@H]1CCCNC1 SPC-g045 [0,0,0,1,0,0|2,0,1]=4 67 B7R1.3 O[C@H]1CCCNC1 SPC-h058 [0,0,0,1,0,0|2,0,1]=4 68 B7R1.3 O[C@H]1CCCOC1 SPC-h213 [0,0,0,1,0,0|1,0,2]=4 69 B7R1.3 O[C@H]1CCCOC1 SPC-u595 [0,0,0,1,0,0|1,0,2]=4 70 B7R1.3 S[C@H]1CCCNC1 SPC-n485 [0,0,0,1,0,0|2,0,1]=4 71 B7R1.4 CC1CNCC1C SPC-t668 [0,0,0,1,0,0|2,0,1]=4 72 B7R1.4 C[C@@H]1CNC[C@@H]1O SPC-r275 [0,0,0,1,0,0|1,0,2]=4 73 B7R1.4 C[C@@H]1CNC[C@H]1O SPC-r274 [0,0,0,1,0,0|1,0,2]=4 74 B7R1.4 C[C@@H]1COC[C@H]1N SPC-q478 [0,0,0,1,0,0|2,0,1]=4 75 B7R1.4 N[C@@H]1CCC[C@@H]1O SPC-q799 [0,0,0,1,0,0|1,0,2]=4 76 B7R1.4 N[C@@H]1CCC[C@@H]1O SPC-v328 [0,0,0,1,0,0|1,0,2]=4 77 B7R1.4 N[C@@H]1CCC[C@H]1F SPC-t364 [0,0,0,1,0,0|2,0,1]=4 78 B7R1.4 N[C@@H]1CCC[C@H]1N SPC-q798 [0,0,0,1,0,0|2,0,1]=4 79 B7R1.4 N[C@@H]1CCC[C@H]1O SPC-k050 [0,0,0,1,0,0|1,0,2]=4 80 B7R1.4 N[C@H]1CCC[C@@H]1O SPC-k049 [0,0,0,1,0,0|1,0,2]=4 81 B7R1.4 N[C@H]1CCC[C@H]1N SPC-s473 [0,0,0,1,0,0|2,0,1]=4 82 B7R1.4 N[C@H]1CCC[C@H]1O SPC-s007 [0,0,0,1,0,0|1,0,2]=4 83 B7R1.4 N[C@H]1CCNC1=O SPC-u507 [0,0,0,1,0,0|2,0,0]=3 84 B7R1.4 N[C@H]1CCOC1=O SPC-s908 [0,0,0,1,0,0|2,0,0]=3 85 B7R1.6 CCNC1COC1 SPC-a295 [0,0,0,1,0,0|1,0,2]=4 86 B7R1.6 CCOC1CNC1 SPC-u336 [0,0,0,1,0,0|2,0,1]=4 87 B7R1.6 CNCC1COC1 SPC-a301 [0,0,0,1,0,0|1,0,2]=4 88 B7R1.6 COCC1CNC1 SPC-h904 [0,0,0,1,0,0|2,0,1]=4 89 B7R1.6 COCC1CNC1 SPC-h928 [0,0,0,1,0,0|2,0,1]=4 90 B7R1.6 COC[C@@H]1CCN1 SPC-i094 [0,0,0,1,0,0|3,0,0]=4 91 B7R1.6 COC[C@@H]1CCN1 SPC-n711 [0,0,0,1,0,0|3,0,0]=4 92 B7R1.6 COC[C@H]1CCN1 SPC-h990 [0,0,0,1,0,0|3,0,0]=4 93 B7R1.6 COC[C@H]1CCN1 SPC-i646 [0,0,0,1,0,0|3,0,0]=4 94 B7R1.6 NCCC1CCC1 SPC-p217 [0,0,0,1,0,0|2,0,1]=4 95 B7R1.6 NCCC1COC1 SPC-t456 [0,0,0,1,0,0|1,0,2]=4 96 B7R1.6 NCC[C@H]1CCO1 SPC-s809 [0,0,0,1,0,0|3,0,0]=4 97 B7R1.6 OCCC1CNC1 SPC-a312 [0,0,0,1,0,0|2,0,1]=4 98 B7R1.6 OCCC1CNC1 SPC-q679 [0,0,0,1,0,0|2,0,1]=4 99 B7R1.6 OCCC1COC1 SPC-a030 [0,0,0,1,0,0|1,0,2]=4 100 B7R1.6 OCC[C@H]1CCO1 SPC-t605 [0,0,0,1,0,0|3,0,0]=4 101 B7R1.10 CN1CC(CN)C1 SPC-a123 [0,0,0,1,0,0|2,0,1]=4 102 B7R1.10 CN1CC(CO)C1 SPC-m755 [0,0,0,1,0,0|1,0,2]=4 103 B7R1.10 CNC1CN(C)C1 SPC-h979 [0,0,0,1,0,0|3,0,0]=4 104 B7R1.10 CN[C@H]1C[C@H](O)C1 SPC-i936 [0,0,0,1,0,0|3,0,0]=4 105 B7R1.10 COC1CC(N)C1 SPC-h655 [0,0,0,1,0,0|3,0,0]=4 106 B7R1.10 N#CC1CC(F)C1 SPC-q757 [0,0,0,1,0,0|2,0,1]=4 107 B7R1.10 N#CC1CC(O)C1 SPC-i870 [0,0,0,1,0,0|2,0,1]=4 108 B7R1.10 N#C[C@H]1C[C@@H](O)C1 SPC-u824 [0,0,0,1,0,0|2,0,1]=4 109 B7R1.10 N#C[C@H]1C[C@H](N)C1 SPC-t371 [0,0,0,1,0,0|2,0,1]=4 110 B7R1.10 N#C[C@H]1C[C@H](O)C1 SPC-v028 [0,0,0,1,0,0|2,0,1]=4 111 B7R1.10 NC1CC(CO)C1 SPC-h550 [0,0,0,1,0,0|1,0,2]=4 112 B7R1.10 NCC1CC(F)C1 SPC-h035 [0,0,0,1,0,0|2,0,1]=4 113 B7R1.10 NCC1CC(O)C1 SPC-i622 [0,0,0,1,0,0|2,0,1]=4 114 B7R1.10 NC[C@H]1C[C@@H](O)C1 SPC-h960 [0,0,0,1,0,0|2,0,1]=4 115 B7R1.10 NC[C@H]1C[C@H](O)C1 SPC-h558 [0,0,0,1,0,0|2,0,1]=4 116 B7R1.10 OCC1CC(Cl)C1 SPC-h593 [0,0,0,1,0,0|1,0,2]=4 117 B7R1.10 OCC1CC(F)C1 SPC-s675 [0,0,0,1,0,0|1,0,2]=4 118 B7R1.10 OCC1CC(O)C1 SPC-v198 [0,0,0,1,0,0|1,0,2]=4 119 B7R1.21 CC1(CCO)CC1 SPC-p066 [0,0,0,1,0,0|2,0,1]=4 120 B7R1.22 CC[C@H](N)C1CC1 SPC-n986 [0,0,0,1,0,0|2,0,1]=4 121 B7R1.22 N[C@H](CO)C1CC1 SPC-t738 [0,0,0,1,0,0|1,0,2]=4 122 B7R1.25 C#CC1(C)COC1 SPC-n057 [0,0,0,1,0,0|2,0,1]=4 123 B7R1.25 C=CC1(N)COC1 SPC-w026 [0,0,0,1,0,0|3,0,0]=4 124 B7R1.25 C=CC1(O)COC1 SPC-i524 [0,0,0,1,0,0|3,0,0]=4 125 B7R1.25 CC1(C#N)CNC1 SPC-h582 [0,0,0,1,0,0|2,0,1]=4 126 B7R1.25 CC1(C#N)COC1 SPC-i359 [0,0,0,1,0,0|2,0,1]=4 127 B7R1.25 CC1(C=O)COC1 SPC-a029 [0,0,0,1,0,0|1,0,0]=2 128 B7R1.25 CC1(CBr)COC1 SPC-h211 [0,0,0,1,0,0|2,0,1]=4 129 B7R1.25 CC1(CI)COC1 SPC-g872 [0,0,0,1,0,0|2,0,1]=4 130 B7R1.25 CC1(CN)CCC1 SPC-h987 [0,0,0,1,0,0|1,0,1]=3 131 B7R1.25 CC1(CN)CNC1 SPC-i294 [0,0,0,1,0,0|2,0,1]=4 132 B7R1.25 CC1(CN)COC1 SPC-a025 [0,0,0,1,0,0|2,0,1]=4 133 B7R1.25 CC1(CO)CCC1 SPC-o100 [0,0,0,1,0,0|0,0,2]=3 134 B7R1.25 CC1(CO)CNC1 SPC-i603 [0,0,0,1,0,0|1,0,2]=4 135 B7R1.25 CC1(CO)COC1 SPC-a028 [0,0,0,1,0,0|1,0,2]=4 136 B7R1.25 CC1(CO)CSC1 SPC-a105 [0,0,0,1,0,0|1,0,2]=4 137 B7R1.25 CNC1(C)COC1 SPC-i109 [0,0,0,1,0,0|3,0,0]=4 138 B7R1.25 CNC1(C)COC1 SPC-i954 [0,0,0,1,0,0|3,0,0]=4 139 B7R1.25 COC1(C)CNC1 SPC-i510 [0,0,0,1,0,0|3,0,0]=4 140 B7R1.25 C[C@]1(CO)CCO1 SPC-v359 [0,0,0,1,0,0|1,0,2]=4 141 B7R1.25 NC1(CO)CCC1 SPC-h940 [0,0,0,1,0,0|1,0,2]=4 142 B7R1.25 NCC1(F)CCC1 SPC-k558 [0,0,0,1,0,0|2,0,1]=4 143 B7R1.25 NCC1(N)CCC1 SPC-w108 [0,0,0,1,0,0|2,0,1]=4 144 B7R1.25 NCC1(O)CCC1 SPC-n896 [0,0,0,1,0,0|2,0,1]=4 145 B4R0.1 CC(=O)CN SPC-t886 [2,0,0,0,0,0|1,0,1]=4 146 B4R0.2 C=CCCO SPC-t137 [2,0,0,0,0,0|1,0,1]=4 147 B6R0.3 CC[C@@H](Br)C(=O)O SPC-t752 [1,1,0,0,0,0|1,0,1]=4 148 B6R0.3 CC[C@H](Br)C(=O)O SPC-t846 [1,1,0,0,0,0|1,0,1]=4 149 B6R0.3 C[C@@H](F)[C@@H](F)CN SPC-w140 [1,1,0,0,0,0|2,0,0]=4 150 B6R0.3 C[C@@H](F)[C@H](F)CN SPC-w143 [1,1,0,0,0,0|2,0,0]=4 151 B6R0.5 CC(F)(F)CCN SPC-w139 [1,1,0,0,0,0|2,0,0]=4 152 B6R0.6 ICCCCCI SPC-m904 [1,1,0,0,0,0|1,0,1]=4 153 B6R1.2 Br[C@H]1CCOC1 SPC-h137 [1,0,0,1,0,0|2,0,0]=4 154 B6R1.2 C[C@@H]1CCCN1 SPC-n701 [1,0,0,1,0,0|1,0,0]=3 155 B6R1.2 C[C@H]1CCCN1 SPC-r295 [1,0,0,1,0,0|1,0,0]=3 156 B6R1.2 F[C@@H]1CCNC1 SPC-g912 [1,0,0,1,0,0|2,0,0]=4 157 B6R1.2 F[C@@H]1CCNC1 SPC-s680 [1,0,0,1,0,0|2,0,0]=4 158 B6R1.2 F[C@H]1CCNC1 SPC-h119 [1,0,0,1,0,0|2,0,0]=4 159 B6R1.2 F[C@H]1CCNC1 SPC-j083 [1,0,0,1,0,0|2,0,0]=4 160 B6R1.2 IC1CCCC1 SPC-n407 [1,0,0,1,0,0|1,0,0]=3 161 B6R1.2 I[C@H]1CCOC1 SPC-h290 [1,0,0,1,0,0|2,0,0]=4 162 B6R1.2 I[C@H]1CCOC1 SPC-j336 [1,0,0,1,0,0|2,0,0]=4 163 B6R1.2 N[C@@H]1CCOC1 SPC-g913 [1,0,0,1,0,0|2,0,0]=4 164 B6R1.2 N[C@H]1CCOC1 SPC-g942 [1,0,0,1,0,0|2,0,0]=4 165 B6R1.2 N[C@H]1CCOC1 SPC-g966 [1,0,0,1,0,0|2,0,0]=4 166 B6R1.2 O=C1CCNC1 SPC-g182 [1,0,0,1,0,0|1,0,1]=4 167 B6R1.2 O=C1CCOC1 SPC-g234 [1,0,0,1,0,0|1,0,1]=4 168 B6R1.2 O[C@@H]1CCNC1 SPC-g149 [1,0,0,1,0,0|1,0,1]=4 169 B6R1.2 O[C@@H]1CCOC1 SPC-g564 [1,0,0,1,0,0|1,0,1]=4 170 B6R1.2 O[C@H]1CCNC1 SPC-g033 [1,0,0,1,0,0|1,0,1]=4 171 B6R1.2 O[C@H]1CCNC1 SPC-g282 [1,0,0,1,0,0|1,0,1]=4 172 B6R1.2 O[C@H]1CCNC1 SPC-g363 [1,0,0,1,0,0|1,0,1]=4 173 B6R1.2 O[C@H]1CCOC1 SPC-g096 [1,0,0,1,0,0|1,0,1]=4 174 B6R1.2 O[C@H]1CCOC1 SPC-g256 [1,0,0,1,0,0|1,0,1]=4 175 B6R1.3 CNCC1CC1 SPC-h311 [1,0,0,1,0,0|1,0,1]=4 176 B6R1.3 ICCC1CC1 SPC-k255 [1,0,0,1,0,0|1,0,1]=4 177 B6R1.3 NCCC1CC1 SPC-t690 [1,0,0,1,0,0|1,0,1]=4 178 B6R1.3 OCCC1CC1 SPC-h056 [1,0,0,1,0,0|1,0,1]=4 179 B6R1.5 CC1CC(=O)C1 SPC-n075 [1,0,0,1,0,0|0,0,1]=3 180 B6R1.5 CN1CC(=O)C1 SPC-i955 [1,0,0,1,0,0|1,0,1]=4 181 B6R1.5 CN1CC(=O)C1 SPC-p044 [1,0,0,1,0,0|1,0,1]=4 182 B6R1.5 CN1CC(Cl)C1 SPC-u755 [1,0,0,1,0,0|2,0,0]=4 183 B6R1.5 CN1CC(N)C1 SPC-a122 [1,0,0,1,0,0|2,0,0]=4 184 B6R1.5 CN1CC(N)C1 SPC-a122 [1,0,0,1,0,0|2,0,0]=4 185 B6R1.5 CN1CC(O)C1 SPC-h814 [1,0,0,1,0,0|1,0,1]=4 186 B6R1.5 C[C@H]1C[C@@H](N)C1 SPC-t414 [1,0,0,1,0,0|1,0,0]=3 187 B6R1.5 NC1CC(=O)C1 SPC-g768 [1,0,0,1,0,0|1,0,1]=4 188 B6R1.5 NC1CC(F)C1 SPC-a126 [1,0,0,1,0,0|2,0,0]=4 189 B6R1.5 NC1CC(N)C1 SPC-k955 [1,0,0,1,0,0|2,0,0]=4 190 B6R1.5 NC1CC(O)C1 SPC-h237 [1,0,0,1,0,0|1,0,1]=4 191 B6R1.5 NC1CC(O)C1 SPC-h906 [1,0,0,1,0,0|1,0,1]=4 192 B6R1.5 N[C@H]1C[C@@H](F)C1 SPC-i447 [1,0,0,1,0,0|2,0,0]=4 193 B6R1.5 N[C@H]1C[C@@H](N)C1 SPC-i052 [1,0,0,1,0,0|2,0,0]=4 194 B6R1.5 N[C@H]1C[C@@H](O)C1 SPC-h453 [1,0,0,1,0,0|1,0,1]=4 195 B6R1.5 N[C@H]1C[C@H](F)C1 SPC-i830 [1,0,0,1,0,0|2,0,0]=4 196 B6R1.5 N[C@H]1C[C@H](N)C1 SPC-i730 [1,0,0,1,0,0|2,0,0]=4 197 B6R1.5 N[C@H]1C[C@H](N)C1 SPC-i825 [1,0,0,1,0,0|2,0,0]=4 198 B6R1.5 N[C@H]1C[C@H](O)C1 SPC-h454 [1,0,0,1,0,0|1,0,1]=4 199 B6R1.5 N[C@H]1C[C@H](O)C1 SPC-i099 [1,0,0,1,0,0|1,0,1]=4 200 B6R1.5 O=C1CC(Br)C1 SPC-i596 [1,0,0,1,0,0|1,0,1]=4 201 B6R1.5 OC1CC(F)C1 SPC-i817 [1,0,0,1,0,0|1,0,1]=4 202 B6R1.5 OC1CC(O)C1 SPC-v254 [1,0,0,1,0,0|1,0,1]=4 203 B6R1.5 O[C@H]1C[C@@H](F)C1 SPC-p948 [1,0,0,1,0,0|1,0,1]=4 204 B6R1.5 O[C@H]1C[C@H](F)C1 SPC-q477 [1,0,0,1,0,0|1,0,1]=4 205 B6R1.10 CC1(C)CNC1 SPC-h500 [1,0,0,1,0,0|1,0,1]=4 206 B6R1.10 CC1(F)CNC1 SPC-i733 [1,0,0,1,0,0|2,0,0]=4 207 B6R1.10 CC1(N)CCC1 SPC-h418 [1,0,0,1,0,0|1,0,0]=3 208 B6R1.10 CC1(N)CNC1 SPC-i010 [1,0,0,1,0,0|2,0,0]=4 209 B6R1.10 CC1(N)COC1 SPC-a024 [1,0,0,1,0,0|2,0,0]=4 210 B6R1.10 CC1(N)COC1 SPC-h792 [1,0,0,1,0,0|2,0,0]=4 211 B6R1.10 CC1(N)CSC1 SPC-i986 [1,0,0,1,0,0|2,0,0]=4 212 B6R1.10 CC1(O)CNC1 SPC-g917 [1,0,0,1,0,0|1,0,1]=4 213 B6R1.10 CC1(O)COC1 SPC-a027 [1,0,0,1,0,0|1,0,1]=4 214 B6R1.10 CC1(O)CSC1 SPC-n024 [1,0,0,1,0,0|1,0,1]=4 215 B6R1.10 N=S1(=O)CCC1 SPC-w058 [1,0,0,1,0,0|2,0,0]=4 216 B6R1.11 C[C@@H](N)C1CC1 SPC-v104 [1,0,0,1,0,0|1,0,0]=3 217 B6R1.11 C[C@H](N)C1CC1 SPC-n670 [1,0,0,1,0,0|1,0,0]=3 218 B6R1.11 NC(=O)C1CC1 SPC-t155 [1,0,0,1,0,0|1,0,1]=4 219 B6R1.1 C1=CCNCC1 SPC-g659 [1,0,0,1,0,0|2,0,0]=4 220 B6R1.1 C1=CCOCC1 SPC-h047 [1,0,0,1,0,0|2,0,0]=4 221 B6R1.4 C[C@@H]1OCC1=O SPC-p252 [1,0,0,1,0,0|1,0,0]=3 222 B6R1.4 N[C@@H]1CNC1=O SPC-u597 [1,0,0,1,0,0|2,0,0]=4 223 B6R1.4 N[C@H]1CNC1=O SPC-s686 [1,0,0,1,0,0|2,0,0]=4 224 B6R1.4 O=C1CC[C@@H]1Br SPC-u765 [1,0,0,1,0,0|1,0,0]=3 225 B6R1.6 ICC1CCC1 SPC-m826 [1,0,0,1,0,0|1,0,1]=4 226 B6R1.6 NCC1CCC1 SPC-a097 [1,0,0,1,0,0|1,0,1]=4 227 B6R1.6 NCC1CCC1 SPC-g882 [1,0,0,1,0,0|1,0,1]=4 228 B6R1.6 O=CC1COC1 SPC-r007 [1,0,0,1,0,0|1,0,0]=3 229 B6R1.7 CC1(CO)CC1 SPC-s643 [1,0,0,1,0,0|0,0,2]=4 230 B8R1.1 CN1CC[C@@H](CN)C1 SPC-m834 [0,1,0,1,0,0|1,0,1]=4 231 B8R1.1 CN1CC[C@@H](CN)C1 SPC-m835 [0,1,0,1,0,0|1,0,1]=4 232 B8R1.1 CN1CC[C@@H](CO)C1 SPC-j335 [0,1,0,1,0,0|0,0,2]=4 233 B8R1.1 CN1CC[C@H](CN)C1 SPC-h345 [0,1,0,1,0,0|1,0,1]=4 234 B8R1.1 CN1CC[C@H](CN)C1 SPC-n837 [0,1,0,1,0,0|1,0,1]=4 235 B8R1.1 CN1CC[C@H](CO)C1 SPC-j334 [0,1,0,1,0,0|0,0,2]=4 236 B8R1.4 CC1CC(N)CCO1 SPC-m997 [0,1,0,1,0,0|2,0,0]=4 237 B8R1.4 CC1CC(O)CCN1 SPC-p253 [0,1,0,1,0,0|2,0,0]=4 238 B8R1.4 CC1CC(O)CCN1 SPC-r050 [0,1,0,1,0,0|2,0,0]=4 239 B8R1.4 CC1CC(O)CCO1 SPC-g891 [0,1,0,1,0,0|2,0,0]=4 240 B8R1.4 C[C@@H]1CC(=O)CCN1 SPC-j888 [0,1,0,1,0,0|1,0,0]=3 241 B8R1.4 C[C@@H]1CNCC(=O)N1 SPC-n811 [0,1,0,1,0,0|1,0,0]=3 242 B8R1.4 C[C@@H]1C[C@H](O)CCN1 SPC-m097 [0,1,0,1,0,0|2,0,0]=4 243 B8R1.4 C[C@H]1CC(=O)CCN1 SPC-j895 [0,1,0,1,0,0|1,0,0]=3 244 B8R1.4 C[C@H]1CC(=O)CCN1 SPC-m537 [0,1,0,1,0,0|1,0,0]=3 245 B8R1.4 C[C@H]1CC(=O)CCN1 SPC-n719 [0,1,0,1,0,0|1,0,0]=3 246 B8R1.4 C[C@H]1CC(=O)CCO1 SPC-k855 [0,1,0,1,0,0|1,0,0]=3 247 B8R1.4 C[C@H]1CCNC(=O)C1 SPC-p144 [0,1,0,1,0,0|1,0,0]=3 248 B8R1.4 C[C@H]1CNCC(=O)N1 SPC-n812 [0,1,0,1,0,0|1,0,0]=3 249 B8R1.4 C[C@H]1C[C@@H](O)CCN1 SPC-u060 [0,1,0,1,0,0|2,0,0]=4 250 B8R1.4 N[C@@H]1COCC(=O)C1 SPC-u616 [0,1,0,1,0,0|2,0,0]=4 251 B8R1.4 N[C@H]1CCNC(=O)C1 SPC-j029 [0,1,0,1,0,0|2,0,0]=4 252 B8R1.4 O=C1CCC[C@H](O)C1 SPC-p385 [0,1,0,1,0,0|1,0,0]=3 253 B8R1.18 CN1C[C@@H](N)CC1=O SPC-p485 [0,1,0,1,0,0|1,0,0]=3 254 B8R1.43 N#CC1CC1C(=O)O SPC-t815 [0,1,0,1,0,0|1,0,1]=4 255 B8R1.43 N#C[C@@H]1C[C@H]1C(=O)O SPC-q468 [0,1,0,1,0,0|1,0,1]=4 256 B8R1.43 N#C[C@H]1C[C@H]1C(=O)O SPC-k256 [0,1,0,1,0,0|1,0,1]=4 257 B8R1.43 NCC1CC1C(=O)O SPC-v399 [0,1,0,1,0,0|1,0,0]=3 258 B8R1.53 CC1(C)CC(CBr)C1 SPC-i233 [0,1,0,1,0,0|1,0,1]=4 259 B8R1.53 CC1(C)CC(CN)C1 SPC-i127 [0,1,0,1,0,0|1,0,1]=4 260 B8R1.53 CC1(C)CC(CO)C1 SPC-i522 [0,1,0,1,0,0|0,0,2]=4 261 B8R1.53 CC1(O)CC(CN)C1 SPC-u218 [0,1,0,1,0,0|1,0,1]=4 262 B8R1.53 C[C@]1(O)C[C@@H](CN)C1 SPC-w124 [0,1,0,1,0,0|1,0,1]=4 263 B8R1.53 C[C@]1(O)C[C@H](CN)C1 SPC-w123 [0,1,0,1,0,0|1,0,1]=4 264 B8R1.53 O=CC1CC(F)(F)C1 SPC-w200 [0,1,0,1,0,0|1,0,0]=3 265 B8R1.2 BrCC1=CCCCC1 SPC-j295 [0,1,0,1,0,0|1,0,1]=4 266 B8R1.2 BrCC1CCNCC1 SPC-j960 [0,1,0,1,0,0|1,0,1]=4 267 B8R1.2 BrCC1CCOCC1 SPC-g566 [0,1,0,1,0,0|1,0,1]=4 268 B8R1.2 BrC[C@H]1CCCOC1 SPC-h690 [0,1,0,1,0,0|0,0,2]=4 269 B8R1.2 C#CC1CCNCC1 SPC-i535 [0,1,0,1,0,0|1,0,1]=4 270 B8R1.2 C#CC1CCOCC1 SPC-h622 [0,1,0,1,0,0|1,0,1]=4 271 B8R1.2 C#CC1CCSCC1 SPC-t009 [0,1,0,1,0,0|1,0,1]=4 272 B8R1.2 C#C[C@H]1CCCNC1 SPC-p374 [0,1,0,1,0,0|1,0,1]=4 273 B8R1.2 CNC1CCNCC1 SPC-q226 [0,1,0,1,0,0|2,0,0]=4 274 B8R1.2 CNC1CCOCC1 SPC-j064 [0,1,0,1,0,0|2,0,0]=4 275 B8R1.2 COC1CCNCC1 SPC-g777 [0,1,0,1,0,0|2,0,0]=4 276 B8R1.2 COC1CCNCC1 SPC-n150 [0,1,0,1,0,0|2,0,0]=4 277 B8R1.2 CO[C@@H]1CCCNC1 SPC-r030 [0,1,0,1,0,0|1,0,1]=4 278 B8R1.2 CO[C@H]1CCCNC1 SPC-h111 [0,1,0,1,0,0|1,0,1]=4 279 B8R1.2 CO[C@H]1CCCNC1 SPC-j189 [0,1,0,1,0,0|1,0,1]=4 280 B8R1.2 CSC1CCNCC1 SPC-g968 [0,1,0,1,0,0|2,0,0]=4 281 B8R1.2 ClCC1CCNCC1 SPC-s961 [0,1,0,1,0,0|1,0,1]=4 282 B8R1.2 FCC1CCNCC1 SPC-n102 [0,1,0,1,0,0|1,0,1]=4 283 B8R1.2 ICC1CCOCC1 SPC-g906 [0,1,0,1,0,0|1,0,1]=4 284 B8R1.2 N#CC1CCNCC1 SPC-j199 [0,1,0,1,0,0|1,0,1]=4 285 B8R1.2 N#CC1CCOCC1 SPC-g531 [0,1,0,1,0,0|1,0,1]=4 286 B8R1.2 N#CC1CCSCC1 SPC-n629 [0,1,0,1,0,0|1,0,1]=4 287 B8R1.2 N#C[C@@H]1CCCCN1 SPC-p920 [0,1,0,1,0,0|1,0,1]=4 288 B8R1.2 N#C[C@@H]1CCCCN1 SPC-s671 [0,1,0,1,0,0|1,0,1]=4 289 B8R1.2 N#C[C@@H]1CCCNC1 SPC-m702 [0,1,0,1,0,0|1,0,1]=4 290 B8R1.2 N#C[C@H]1CCCCN1 SPC-s657 [0,1,0,1,0,0|1,0,1]=4 291 B8R1.2 N#C[C@H]1CCCNC1 SPC-h106 [0,1,0,1,0,0|1,0,1]=4 292 B8R1.2 N#C[C@H]1CCCNC1 SPC-q605 [0,1,0,1,0,0|1,0,1]=4 293 B8R1.2 NCC1CCOCC1 SPC-g253 [0,1,0,1,0,0|1,0,1]=4 294 B8R1.2 NCC1CCSCC1 SPC-j796 [0,1,0,1,0,0|1,0,1]=4 295 B8R1.2 NCC1CCSCC1 SPC-t703 [0,1,0,1,0,0|1,0,1]=4 296 B8R1.2 NC[C@@H]1CCCOC1 SPC-n840 [0,1,0,1,0,0|0,0,2]=4 297 B8R1.2 NC[C@H]1CCCOC1 SPC-n838 [0,1,0,1,0,0|0,0,2]=4 298 B8R1.2 NC[C@H]1CCCOC1 SPC-r352 [0,1,0,1,0,0|0,0,2]=4 299 B8R1.2 NNC1CCOCC1 SPC-m554 [0,1,0,1,0,0|2,0,0]=4 300 B8R1.2 NN[C@H]1CCCOC1 SPC-t975 [0,1,0,1,0,0|2,0,0]=4 301 B8R1.2 O=C[C@@H]1CCC=CO1 SPC-s265 [0,1,0,1,0,0|0,0,2]=4 302 B8R1.2 OCC1CCNCC1 SPC-g261 [0,1,0,1,0,0|0,0,2]=4 303 B8R1.2 OCC1CCOCC1 SPC-g300 [0,1,0,1,0,0|0,0,2]=4 304 B8R1.2 OC[C@@H]1CCCCO1 SPC-v087 [0,1,0,1,0,0|0,0,2]=4 305 B8R1.2 OC[C@@H]1CCCNC1 SPC-v455 [0,1,0,1,0,0|0,0,2]=4 306 B8R1.2 OC[C@@H]1CCCOC1 SPC-v644 [0,1,0,1,0,0|0,0,2]=4 307 B8R1.2 OC[C@H]1CCCCO1 SPC-s718 [0,1,0,1,0,0|0,0,2]=4 308 B8R1.2 OC[C@H]1CCCCO1 SPC-v058 [0,1,0,1,0,0|0,0,2]=4 309 B8R1.2 OC[C@H]1CCCOC1 SPC-h333 [0,1,0,1,0,0|0,0,2]=4 310 B8R1.2 OC[C@H]1CCCOC1 SPC-u991 [0,1,0,1,0,0|0,0,2]=4 311 B8R1.3 C[C@@H]1C=CC(=O)CC1 SPC-s978 [0,1,0,1,0,0|1,0,1]=4 312 B8R1.3 C[C@H]1CC[C@@H](O)CN1 SPC-u032 [0,1,0,1,0,0|2,0,0]=4 313 B8R1.5 CC1CCNCC1O SPC-p589 [0,1,0,1,0,0|0,0,2]=4 314 B8R1.5 CC1CNCCC1O SPC-m644 [0,1,0,1,0,0|0,0,2]=4 315 B8R1.5 CN1CCNCC1=O SPC-j564 [0,1,0,1,0,0|1,0,0]=3 316 B8R1.5 CN1CCNCC1=O SPC-r023 [0,1,0,1,0,0|1,0,0]=3 317 B8R1.5 C[C@@H]1CCCN[C@@H]1C SPC-u259 [0,1,0,1,0,0|1,0,1]=4 318 B8R1.5 C[C@@H]1CCNC[C@H]1O SPC-q479 [0,1,0,1,0,0|0,0,2]=4 319 B8R1.5 C[C@@H]1CNCCN1C SPC-j879 [0,1,0,1,0,0|2,0,0]=4 320 B8R1.5 C[C@@H]1CNCCN1C SPC-r024 [0,1,0,1,0,0|2,0,0]=4 321 B8R1.5 C[C@H]1CCNC[C@H]1O SPC-p949 [0,1,0,1,0,0|0,0,2]=4 322 B8R1.5 C[C@H]1CNCCC1=O SPC-n076 [0,1,0,1,0,0|0,0,0]=2 323 B8R1.5 C[C@H]1CNCCN1C SPC-k695 [0,1,0,1,0,0|2,0,0]=4 324 B8R1.5 C[C@H]1CNCCN1C SPC-m797 [0,1,0,1,0,0|2,0,0]=4 325 B8R1.5 C[C@H]1COCCC1=O SPC-p410 [0,1,0,1,0,0|0,0,0]=2 326 B8R1.5 O=C1CCNC[C@@H]1F SPC-g858 [0,1,0,1,0,0|1,0,0]=3 327 B8R1.5 O=C1CCOC[C@@H]1Br SPC-h143 [0,1,0,1,0,0|1,0,0]=3 328 B8R1.5 O=C1CCOC[C@@H]1F SPC-p380 [0,1,0,1,0,0|1,0,0]=3 329 B8R1.10 OCCCC1CNC1 SPC-a313 [0,1,0,1,0,0|1,0,1]=4 330 B8R1.22 C[C@H]1CCNCCN1 SPC-n217 [0,1,0,1,0,0|2,0,0]=4 331 B8R1.38 CC(CO)C1CCO1 SPC-s810 [0,1,0,1,0,0|0,0,2]=4 332 B8R1.47 CCN1CC(CN)C1 SPC-u779 [0,1,0,1,0,0|1,0,1]=4 333 B8R1.47 CO[C@H]1C[C@@H](CN)C1 SPC-q755 [0,1,0,1,0,0|1,0,1]=4 334 B8R1.50 CN1CC[C@@H](N)C1=O SPC-v521 [0,1,0,1,0,0|1,0,0]=3 335 B8R1.52 C[C@@]1(CO)CCCN1 SPC-m261 [0,1,0,1,0,0|0,0,2]=4 336 B8R1.52 C[C@]1(C#N)CCNC1 SPC-p412 [0,1,0,1,0,0|1,0,1]=4 337 B8R1.52 C[C@]1(CN)CCCO1 SPC-s725 [0,1,0,1,0,0|1,0,1]=4 338 B8R1.52 C[C@]1(CN)CCOC1 SPC-h504 [0,1,0,1,0,0|1,0,1]=4 339 B8R1.52 C[C@]1(CO)CCCN1 SPC-m267 [0,1,0,1,0,0|0,0,2]=4 340 B8R1.52 NCC1(F)CCCC1 SPC-s642 [0,1,0,1,0,0|1,0,1]=4 341 B8R1.52 NCC1(O)CCCC1 SPC-n897 [0,1,0,1,0,0|1,0,1]=4 342 B8R1.52 NCC1(O)CCCC1 SPC-s734 [0,1,0,1,0,0|1,0,1]=4 343 B8R1.7 C[C@H](N)C1CCCC1 SPC-s771 [0,1,0,1,0,0|1,0,1]=4 344 B8R1.7 NC(=O)[C@@H]1CCCN1 SPC-m512 [0,1,0,1,0,0|1,0,0]=3 345 B8R1.7 NC(=O)[C@@H]1CCNC1 SPC-i613 [0,1,0,1,0,0|1,0,0]=3 346 B8R1.7 NC(=O)[C@H]1CCNC1 SPC-h374 [0,1,0,1,0,0|1,0,0]=3 347 B8R1.7 NC(=O)[C@H]1CCNC1 SPC-j214 [0,1,0,1,0,0|1,0,0]=3 348 B8R1.7 NC(=O)[C@H]1CCOC1 SPC-m339 [0,1,0,1,0,0|1,0,0]=3 349 B8R1.7 O=C(O)C1CC=CC1 SPC-g185 [0,1,0,1,0,0|0,0,2]=4 350 B8R1.7 O=C(O)C1CCCC1 SPC-k222 [0,1,0,1,0,0|0,0,0]=2 351 B8R1.7 O=C(O)[C@@H]1CCNC1 SPC-n752 [0,1,0,1,0,0|1,0,0]=3 352 B8R1.7 O=C(O)[C@@H]1CCNC1 SPC-s684 [0,1,0,1,0,0|1,0,0]=3 353 B8R1.7 O=C(O)[C@@H]1CCOC1 SPC-h613 [0,1,0,1,0,0|1,0,0]=3 354 B8R1.7 O=C(O)[C@H]1CCNC1 SPC-g474 [0,1,0,1,0,0|1,0,0]=3 355 B8R1.7 O=C(O)[C@H]1CCNC1 SPC-j200 [0,1,0,1,0,0|1,0,0]=3 356 B8R1.7 O=C(O)[C@H]1CCNC1 SPC-t662 [0,1,0,1,0,0|1,0,0]=3 357 B8R1.7 O=C(O)[C@H]1CCOC1 SPC-g501 [0,1,0,1,0,0|1,0,0]=3 358 B8R1.7 O=C(O)[C@H]1CCOC1 SPC-j337 [0,1,0,1,0,0|1,0,0]=3 359 B8R1.19 CC1(C)CCCC1=O SPC-q787 [0,1,0,1,0,0|0,0,0]=2 360 B8R1.19 CC1(C)OCCC1=O SPC-v121 [0,1,0,1,0,0|1,0,0]=3 361 B8R1.19 O=C1NCCC1(F)F SPC-p295 [0,1,0,1,0,0|2,0,0]=4 362 B8R1.23 C=C1CC(C(=O)O)C1 SPC-g775 [0,1,0,1,0,0|0,0,2]=4 363 B8R1.23 CC(=O)C1CC(O)C1 SPC-v350 [0,1,0,1,0,0|1,0,0]=3 364 B8R1.23 CC(=O)N1CC(N)C1 SPC-h425 [0,1,0,1,0,0|2,0,0]=4 365 B8R1.23 CC(=O)N1CC(O)C1 SPC-h857 [0,1,0,1,0,0|2,0,0]=4 366 B8R1.23 CC1CC(C(=O)O)C1 SPC-m202 [0,1,0,1,0,0|0,0,0]=2 367 B8R1.23 CN1CC(C(=O)O)C1 SPC-a114 [0,1,0,1,0,0|1,0,0]=3 368 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 SPC-i346 [0,1,0,1,0,0|0,0,0]=2 369 B8R1.23 C[C@H]1C[C@H](C(=O)O)C1 SPC-i384 [0,1,0,1,0,0|0,0,0]=2 370 B8R1.23 NC1CC(C(=O)O)C1 SPC-q735 [0,1,0,1,0,0|1,0,0]=3 371 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 SPC-h937 [0,1,0,1,0,0|1,0,0]=3 372 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 SPC-i508 [0,1,0,1,0,0|1,0,0]=3 373 B8R1.23 O=C(O)C1CC(Cl)C1 SPC-h856 [0,1,0,1,0,0|1,0,0]=3 374 B8R1.23 O=C(O)C1CC(F)C1 SPC-a125 [0,1,0,1,0,0|1,0,0]=3 375 B8R1.23 O=C(O)C1CC(O)C1 SPC-p384 [0,1,0,1,0,0|1,0,0]=3 376 B8R1.23 O=C(O)[C@H]1C[C@@H](F)C1 SPC-q739 [0,1,0,1,0,0|1,0,0]=3 377 B8R1.23 O=C(O)[C@H]1C[C@@H](O)C1 SPC-h918 [0,1,0,1,0,0|1,0,0]=3 378 B8R1.23 O=C(O)[C@H]1C[C@H](Cl)C1 SPC-h952 [0,1,0,1,0,0|1,0,0]=3 379 B8R1.23 O=C(O)[C@H]1C[C@H](F)C1 SPC-q738 [0,1,0,1,0,0|1,0,0]=3 380 B8R1.23 O=C(O)[C@H]1C[C@H](O)C1 SPC-i654 [0,1,0,1,0,0|1,0,0]=3 381 B8R1.23 O=C1CC(C(=O)O)C1 SPC-g640 [0,1,0,1,0,0|1,0,1]=4 382 B8R1.78 CC(=O)C1(C)COC1 SPC-h427 [0,1,0,1,0,0|1,0,0]=3 383 B8R1.78 CC1(C(=O)O)CCC1 SPC-h853 [0,1,0,1,0,0|0,0,0]=2 384 B8R1.78 CC1(C(=O)O)CNC1 SPC-n023 [0,1,0,1,0,0|1,0,0]=3 385 B8R1.78 CC1(C(=O)O)COC1 SPC-a022 [0,1,0,1,0,0|1,0,0]=3 386 B8R1.78 C[C@@]1(C(=O)O)CCO1 SPC-w005 [0,1,0,1,0,0|1,0,0]=3 387 B8R1.78 C[C@@]1(C(=O)O)CCO1 SPC-w005 [0,1,0,1,0,0|1,0,0]=3 388 B8R1.78 NC1(C(=O)O)CCC1 SPC-h208 [0,1,0,1,0,0|1,0,0]=3 389 B8R1.78 NC1(C(=O)O)CCC1 SPC-h754 [0,1,0,1,0,0|1,0,0]=3 390 B8R1.78 NC1(C(=O)O)CNC1 SPC-i658 [0,1,0,1,0,0|2,0,0]=4 391 B8R1.78 NC1(C(=O)O)COC1 SPC-a068 [0,1,0,1,0,0|2,0,0]=4 392 B8R1.78 O=C(O)C1(Br)CCC1 SPC-t595 [0,1,0,1,0,0|1,0,0]=3 393 B8R1.78 O=C(O)C1(F)CNC1 SPC-i807 [0,1,0,1,0,0|2,0,0]=4 394 B8R1.78 O=C(O)C1(O)CCC1 SPC-n942 [0,1,0,1,0,0|1,0,0]=3 395 B8R1.78 O=C(O)C1(O)CNC1 SPC-p383 [0,1,0,1,0,0|2,0,0]=4 396 B8R1.78 O=C(O)C1(O)COC1 SPC-r004 [0,1,0,1,0,0|2,0,0]=4 397 B8R1.6 N#CCC1CC(=O)C1 SPC-p082 [0,1,0,1,0,0|1,0,1]=4 398 B8R1.8 NNCC1CCCC1 SPC-v623 [0,1,0,1,0,0|1,0,1]=4 399 B8R1.11 CN1CCC[C@@H]1CN SPC-m569 [0,1,0,1,0,0|1,0,1]=4 400 B8R1.11 CN1CCC[C@H]1CN SPC-h913 [0,1,0,1,0,0|1,0,1]=4 401 B8R1.11 N#C[C@H]1COCC1=O SPC-p597 [0,1,0,1,0,0|1,0,1]=4 402 B8R1.11 N#C[C@H]1CSCC1=O SPC-p598 [0,1,0,1,0,0|1,0,1]=4 403 B8R1.11 O=C1NCC[C@@H]1CO SPC-k007 [0,1,0,1,0,0|1,0,0]=3 404 B8R1.72 C[C@]1(O)CCCNC1 SPC-h456 [0,1,0,1,0,0|1,0,1]=4 405 B8R1.72 C[C@]1(O)CCCNC1 SPC-u662 [0,1,0,1,0,0|1,0,1]=4 406 B8R1.60 CCC1(C=O)COC1 SPC-h844 [0,1,0,1,0,0|1,0,0]=3 407 B8R1.60 NCC1(CN)CCC1 SPC-k460 [0,1,0,1,0,0|1,0,1]=4 408 B8R1.60 NCC1(CO)CCC1 SPC-h921 [0,1,0,1,0,0|0,0,2]=4 409 B8R1.60 OCC1(CO)CCC1 SPC-a321 [0,1,0,1,0,0|0,0,2]=4 410 B8R2.34 C1=CC2CC1CN2 SPC-n324 [0,0,0,2,0,0|2,0,0]=4 411 B8R2.34 C1CC2CC1CN2 SPC-p168 [0,0,0,2,0,0|1,0,1]=4 412 B8R2.23 C1CC2CC(C1)N2 SPC-w304 [0,0,0,2,0,0|2,0,0]=4 413 B8R2.23 C1NCC2CC1C2 SPC-a319 [0,0,0,2,0,0|1,0,1]=4 414 B8R2.31 BrCC12CC(C1)C2 SPC-a771 [0,0,0,2,0,0|1,0,1]=4 415 B8R2.31 N#CC12CC(C1)C2 SPC-a795 [0,0,0,2,0,0|1,0,1]=4 416 B8R2.31 NCC12CC(C1)C2 SPC-a949 [0,0,0,2,0,0|1,0,1]=4 417 B8R2.31 NCC12CC(C1)C2 SPC-o061 [0,0,0,2,0,0|1,0,1]=4 418 B8R2.31 NNC12CC(C1)C2 SPC-a430 [0,0,0,2,0,0|2,0,0]=4 419 B8R2.31 OCC12CC(C1)C2 SPC-a828 [0,0,0,2,0,0|0,0,2]=4