0 B9R1.6 CC(=O)C1CCCCC1 SPC-g619 [0,0,0,0,0,0|1,0,0]=1 1 B9R1.6 CC(=O)C1CCOCC1 SPC-k706 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.6 CC(=O)N1CCNCC1 SPC-n912 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.6 FC(F)C1CCNCC1 SPC-k867 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.6 N=C(N)C1CCOCC1 SPC-k727 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.6 NC(=O)C1CCNCC1 SPC-g456 [0,0,0,0,0,0|2,0,0]=2 6 B9R1.6 NC(=O)[C@@H]1CCCNC1 SPC-j215 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.6 NC(=O)[C@@H]1CCCNC1 SPC-v613 [0,0,0,0,0,0|2,0,0]=2 8 B9R1.6 NC(=O)[C@H]1CCCNC1 SPC-j216 [0,0,0,0,0,0|2,0,0]=2 9 B9R1.6 O=C(O)C1=COCCC1 SPC-g394 [0,0,0,0,0,0|1,0,2]=3 10 B9R1.6 O=C(O)C1CCNCC1 SPC-h780 [0,0,0,0,0,0|1,0,0]=1 11 B9R1.6 O=C(O)C1CCSCC1 SPC-a119 [0,0,0,0,0,0|1,0,0]=1 12 B9R1.6 O=C(O)[C@@H]1CC=CCC1 SPC-g244 [0,0,0,0,0,0|0,0,2]=2 13 B9R1.6 O=C(O)[C@@H]1CCCCO1 SPC-n720 [0,0,0,0,0,0|1,0,0]=1 14 B9R1.6 O=C(O)[C@@H]1CCCCO1 SPC-q233 [0,0,0,0,0,0|1,0,0]=1 15 B9R1.6 O=C(O)[C@@H]1CNCCN1 SPC-g431 [0,0,0,0,0,0|2,0,0]=2 16 B9R1.6 O=C(O)[C@@H]1CNCCN1 SPC-t247 [0,0,0,0,0,0|2,0,0]=2 17 B9R1.6 O=C(O)[C@H]1CC=CCC1 SPC-k469 [0,0,0,0,0,0|0,0,2]=2 18 B9R1.6 O=C(O)[C@H]1CCCCO1 SPC-q612 [0,0,0,0,0,0|1,0,0]=1 19 B9R1.6 O=C(O)[C@H]1CCCNC1 SPC-r406 [0,0,0,0,0,0|1,0,0]=1 20 B9R1.6 O=C(O)[C@H]1CCCOC1 SPC-g817 [0,0,0,0,0,0|1,0,0]=1 21 B9R1.6 O=C(O)[C@H]1CCCSC1 SPC-j750 [0,0,0,0,0,0|1,0,0]=1 22 B9R1.6 O=C(O)[C@H]1CNCCN1 SPC-g459 [0,0,0,0,0,0|2,0,0]=2 23 B9R1.6 OB(O)C1=CCCCC1 SPC-m825 [0,0,0,0,0,0|1,0,3]=4 24 B8R1.2 BrCC1CCNCC1 SPC-j960 [1,0,0,0,0,0|2,0,1]=4 25 B8R1.2 BrCC1CCOCC1 SPC-g566 [1,0,0,0,0,0|2,0,1]=4 26 B8R1.2 BrC[C@H]1CCCOC1 SPC-h690 [1,0,0,0,0,0|2,0,1]=4 27 B8R1.2 C#CC1CCNCC1 SPC-i535 [1,0,0,0,0,0|2,0,1]=4 28 B8R1.2 C#CC1CCOCC1 SPC-h622 [1,0,0,0,0,0|2,0,1]=4 29 B8R1.2 C#CC1CCSCC1 SPC-t009 [1,0,0,0,0,0|2,0,1]=4 30 B8R1.2 C#C[C@H]1CCCNC1 SPC-p374 [1,0,0,0,0,0|2,0,1]=4 31 B8R1.2 CNC1CCNCC1 SPC-q226 [1,0,0,0,0,0|3,0,0]=4 32 B8R1.2 CNC1CCOCC1 SPC-j064 [1,0,0,0,0,0|3,0,0]=4 33 B8R1.2 COC1CCNCC1 SPC-g777 [1,0,0,0,0,0|3,0,0]=4 34 B8R1.2 COC1CCNCC1 SPC-n150 [1,0,0,0,0,0|3,0,0]=4 35 B8R1.2 CO[C@@H]1CCCNC1 SPC-r030 [1,0,0,0,0,0|3,0,0]=4 36 B8R1.2 CO[C@H]1CCCNC1 SPC-h111 [1,0,0,0,0,0|3,0,0]=4 37 B8R1.2 CO[C@H]1CCCNC1 SPC-j189 [1,0,0,0,0,0|3,0,0]=4 38 B8R1.2 CSC1CCNCC1 SPC-g968 [1,0,0,0,0,0|3,0,0]=4 39 B8R1.2 ClCC1CCNCC1 SPC-s961 [1,0,0,0,0,0|2,0,1]=4 40 B8R1.2 FCC1CCNCC1 SPC-n102 [1,0,0,0,0,0|2,0,1]=4 41 B8R1.2 ICC1CCOCC1 SPC-g906 [1,0,0,0,0,0|2,0,1]=4 42 B8R1.2 N#CC1CCNCC1 SPC-j199 [1,0,0,0,0,0|2,0,1]=4 43 B8R1.2 N#CC1CCOCC1 SPC-g531 [1,0,0,0,0,0|2,0,1]=4 44 B8R1.2 N#CC1CCSCC1 SPC-n629 [1,0,0,0,0,0|2,0,1]=4 45 B8R1.2 N#C[C@@H]1CCCCN1 SPC-p920 [1,0,0,0,0,0|2,0,1]=4 46 B8R1.2 N#C[C@@H]1CCCCN1 SPC-s671 [1,0,0,0,0,0|2,0,1]=4 47 B8R1.2 N#C[C@@H]1CCCNC1 SPC-m702 [1,0,0,0,0,0|2,0,1]=4 48 B8R1.2 N#C[C@H]1CCCCN1 SPC-s657 [1,0,0,0,0,0|2,0,1]=4 49 B8R1.2 N#C[C@H]1CCCNC1 SPC-h106 [1,0,0,0,0,0|2,0,1]=4 50 B8R1.2 N#C[C@H]1CCCNC1 SPC-q605 [1,0,0,0,0,0|2,0,1]=4 51 B8R1.2 NCC1CCOCC1 SPC-g253 [1,0,0,0,0,0|2,0,1]=4 52 B8R1.2 NCC1CCSCC1 SPC-j796 [1,0,0,0,0,0|2,0,1]=4 53 B8R1.2 NCC1CCSCC1 SPC-t703 [1,0,0,0,0,0|2,0,1]=4 54 B8R1.2 NC[C@@H]1CCCOC1 SPC-n840 [1,0,0,0,0,0|2,0,1]=4 55 B8R1.2 NC[C@H]1CCCOC1 SPC-n838 [1,0,0,0,0,0|2,0,1]=4 56 B8R1.2 NC[C@H]1CCCOC1 SPC-r352 [1,0,0,0,0,0|2,0,1]=4 57 B8R1.2 NNC1CCOCC1 SPC-m554 [1,0,0,0,0,0|3,0,0]=4 58 B8R1.2 NN[C@H]1CCCOC1 SPC-t975 [1,0,0,0,0,0|3,0,0]=4 59 B8R1.2 O=C[C@@H]1CCC=CO1 SPC-s265 [1,0,0,0,0,0|1,0,2]=4 60 B8R1.2 OCC1CCNCC1 SPC-g261 [1,0,0,0,0,0|1,0,1]=3 61 B8R1.2 OCC1CCOCC1 SPC-g300 [1,0,0,0,0,0|1,0,1]=3 62 B8R1.2 OC[C@@H]1CCCCO1 SPC-v087 [1,0,0,0,0,0|1,0,1]=3 63 B8R1.2 OC[C@@H]1CCCNC1 SPC-v455 [1,0,0,0,0,0|1,0,1]=3 64 B8R1.2 OC[C@@H]1CCCOC1 SPC-v644 [1,0,0,0,0,0|1,0,1]=3 65 B8R1.2 OC[C@@H]1CNCCO1 SPC-q930 [1,0,0,0,0,0|2,0,1]=4 66 B8R1.2 OC[C@@H]1COCCO1 SPC-u546 [1,0,0,0,0,0|2,0,1]=4 67 B8R1.2 OC[C@H]1CCCCO1 SPC-s718 [1,0,0,0,0,0|1,0,1]=3 68 B8R1.2 OC[C@H]1CCCCO1 SPC-v058 [1,0,0,0,0,0|1,0,1]=3 69 B8R1.2 OC[C@H]1CCCOC1 SPC-h333 [1,0,0,0,0,0|1,0,1]=3 70 B8R1.2 OC[C@H]1CCCOC1 SPC-u991 [1,0,0,0,0,0|1,0,1]=3 71 B8R1.2 OC[C@H]1CNCCO1 SPC-q931 [1,0,0,0,0,0|2,0,1]=4 72 B8R1.2 OC[C@H]1COCCN1 SPC-n823 [1,0,0,0,0,0|2,0,1]=4 73 B10R1.13 CC(=O)N1CCC(O)CC1 SPC-h835 [0,1,0,0,0,0|2,0,0]=3 74 B10R1.13 CN(C)[C@H]1CC[C@@H](N)CC1 SPC-w176 [0,1,0,0,0,0|3,0,0]=4 75 B10R1.13 N[C@H]1CC[C@@H](C(=O)O)CC1 SPC-m733 [0,1,0,0,0,0|0,0,0]=1 76 B10R1.13 N[C@H]1CC[C@H](C(=O)O)CC1 SPC-g845 [0,1,0,0,0,0|0,0,0]=1 77 B10R1.13 O=C(O)C1CCC(F)CC1 SPC-m707 [0,1,0,0,0,0|0,0,0]=1 78 B10R1.13 O=C(O)C1CCC(O)CC1 SPC-t748 [0,1,0,0,0,0|0,0,0]=1 79 B10R1.13 O=C(O)[C@@H]1CC[C@H](O)CN1 SPC-m080 [0,1,0,0,0,0|1,0,0]=2 80 B10R1.13 O=C(O)[C@H]1CC[C@@H](F)CC1 SPC-q778 [0,1,0,0,0,0|0,0,0]=1 81 B10R1.13 O=C(O)[C@H]1CC[C@@H](O)CC1 SPC-j863 [0,1,0,0,0,0|0,0,0]=1 82 B10R1.13 O=C(O)[C@H]1CC[C@H](F)CC1 SPC-q777 [0,1,0,0,0,0|0,0,0]=1 83 B10R1.13 O=C(O)[C@H]1CC[C@H](O)CC1 SPC-t808 [0,1,0,0,0,0|0,0,0]=1 84 B10R1.13 O=C1CCC(C(=O)O)CC1 SPC-g716 [0,1,0,0,0,0|0,0,1]=2 85 B10R1.13 O=C1CC[C@@H](C(=O)O)NC1 SPC-v713 [0,1,0,0,0,0|1,0,1]=3 86 B10R1.13 O=C1CC[C@H](C(=O)O)CN1 SPC-h266 [0,1,0,0,0,0|1,0,1]=3 87 B10R1.15 CNC(=O)[C@@H]1CCCNC1 SPC-n750 [0,1,0,0,0,0|2,0,0]=3 88 B10R1.15 CNC(=O)[C@H]1CCCNC1 SPC-s691 [0,1,0,0,0,0|2,0,0]=3 89 B10R1.15 COC(=O)C1=CCOCC1 SPC-i055 [0,1,0,0,0,0|1,0,2]=4 90 B10R1.15 COC(=O)C1=CNCCC1 SPC-k316 [0,1,0,0,0,0|1,0,2]=4 91 B10R1.15 COC(=O)C1CCSCC1 SPC-n459 [0,1,0,0,0,0|1,0,0]=2 92 B10R1.15 COC(=O)[C@@H]1CC=CCC1 SPC-t652 [0,1,0,0,0,0|0,0,2]=3 93 B10R1.15 COC(=O)[C@@H]1CCCNC1 SPC-n418 [0,1,0,0,0,0|1,0,0]=2 94 B10R1.15 COC(=O)[C@H]1CCCNC1 SPC-q075 [0,1,0,0,0,0|1,0,0]=2 95 B10R1.15 COC(=O)[C@H]1CCCOC1 SPC-m559 [0,1,0,0,0,0|1,0,0]=2 96 B10R1.15 COC(=O)[C@H]1CNCCN1 SPC-q070 [0,1,0,0,0,0|2,0,0]=3 97 B10R1.15 NNC(=O)[C@H]1CCCOC1 SPC-m239 [0,1,0,0,0,0|2,0,0]=3 98 B10R1.28 CC(C)(O)C1CCCCC1 SPC-p218 [0,1,0,0,0,0|1,0,1]=3 99 B10R1.28 CC(C)(O)C1CCNCC1 SPC-g722 [0,1,0,0,0,0|2,0,1]=4 100 B10R1.28 CS(=O)(=O)C1CCNCC1 SPC-j076 [0,1,0,0,0,0|2,0,1]=4 101 B10R1.28 CS(=O)(=O)[C@H]1CCCNC1 SPC-j198 [0,1,0,0,0,0|2,0,1]=4 102 B10R1.28 CS(=O)(=O)[C@H]1CCCNC1 SPC-m814 [0,1,0,0,0,0|2,0,1]=4 103 B10R1.61 CC(=O)C1CCCCC1F SPC-u650 [0,1,0,0,0,0|1,0,0]=2 104 B10R1.113 CN1CCC[C@@H](C(=O)O)C1 SPC-m806 [0,1,0,0,0,0|1,0,0]=2 105 B10R1.113 CN1CCC[C@H](C(=O)O)C1 SPC-g864 [0,1,0,0,0,0|1,0,0]=2 106 B10R1.113 CN1CCC[C@H](C(=O)O)C1 SPC-m811 [0,1,0,0,0,0|1,0,0]=2 107 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 SPC-g914 [0,1,0,0,0,0|0,0,0]=1 108 B10R1.113 O=C(O)[C@@H]1CCC[C@H](O)C1 SPC-t571 [0,1,0,0,0,0|0,0,0]=1 109 B10R1.113 O=C(O)[C@H]1CCC[C@@H](O)C1 SPC-v191 [0,1,0,0,0,0|0,0,0]=1 110 B10R1.113 O=C1C[C@@H](C(=O)O)CCN1 SPC-j634 [0,1,0,0,0,0|1,0,1]=3 111 B10R1.363 CC(=O)C1(C)CCOCC1 SPC-m358 [0,1,0,0,0,0|2,0,0]=3 112 B10R1.363 CC1(C(=O)O)CCOCC1 SPC-h386 [0,1,0,0,0,0|1,0,0]=2 113 B10R1.363 CC1(C(=O)O)CCSCC1 SPC-j797 [0,1,0,0,0,0|1,0,0]=2 114 B10R1.363 C[C@@]1(C(=O)O)CCCCN1 SPC-r055 [0,1,0,0,0,0|1,0,0]=2 115 B10R1.363 C[C@]1(C(=O)O)CCCCN1 SPC-r042 [0,1,0,0,0,0|1,0,0]=2 116 B10R1.363 C[C@]1(C(=O)O)CCCNC1 SPC-h898 [0,1,0,0,0,0|1,0,0]=2 117 B10R1.363 C[C@]1(C(=O)O)CCCNC1 SPC-k843 [0,1,0,0,0,0|1,0,0]=2 118 B10R1.363 NC1(C(=O)O)CCCCC1 SPC-s757 [0,1,0,0,0,0|0,0,0]=1 119 B10R1.363 NC1(C(=O)O)CCOCC1 SPC-g904 [0,1,0,0,0,0|1,0,0]=2 120 B10R1.363 O=C(O)C1(F)CCOCC1 SPC-p569 [0,1,0,0,0,0|1,0,0]=2 121 B10R1.363 O=C(O)C1(O)CCOCC1 SPC-p576 [0,1,0,0,0,0|1,0,0]=2 122 B10R2.62 O=C1CN2CCC1CC2 SPC-g344 [0,0,0,1,0,0|2,0,0]=3 123 B10R2.62 O=C1NC2CCC1CC2 SPC-k958 [0,0,0,1,0,0|1,0,0]=2 124 B10R2.62 OC1CC2CCC1NC2 SPC-j839 [0,0,0,1,0,0|2,0,1]=4 125 B10R2.62 O[C@H]1CN2CCC1CC2 SPC-s678 [0,0,0,1,0,0|2,0,1]=4 126 B10R2.344 O=C(O)C12CNCC1C2 SPC-p325 [0,0,0,1,0,0|1,0,0]=2 127 B10R2.344 O=C(O)[C@@]12CC1CCN2 SPC-v639 [0,0,0,1,0,0|1,0,0]=2 128 B10R2.351 O=C(O)C1C2CCOC21 SPC-s880 [0,0,0,1,0,0|1,0,0]=2 129 B10R2.355 O=C(O)C1NCC2CC21 SPC-n039 [0,0,0,1,0,0|1,0,0]=2 130 B10R2.357 O=C(O)C1CC2CC2C1 SPC-k476 [0,0,0,1,0,0|0,0,0]=1 131 B8R1.7 C[C@H](N)C1CCCC1 SPC-s771 [0,0,0,0,1,0|2,0,1]=4 132 B8R1.7 NC(=O)[C@@H]1CCCN1 SPC-m512 [0,0,0,0,1,0|2,0,0]=3 133 B8R1.7 NC(=O)[C@@H]1CCNC1 SPC-i613 [0,0,0,0,1,0|2,0,0]=3 134 B8R1.7 NC(=O)[C@H]1CCNC1 SPC-h374 [0,0,0,0,1,0|2,0,0]=3 135 B8R1.7 NC(=O)[C@H]1CCNC1 SPC-j214 [0,0,0,0,1,0|2,0,0]=3 136 B8R1.7 NC(=O)[C@H]1CCOC1 SPC-m339 [0,0,0,0,1,0|2,0,0]=3 137 B8R1.7 O=C(O)C1=COCC1 SPC-g480 [0,0,0,0,1,0|1,0,2]=4 138 B8R1.7 O=C(O)C1CC=CC1 SPC-g185 [0,0,0,0,1,0|0,0,2]=3 139 B8R1.7 O=C(O)C1CCCC1 SPC-k222 [0,0,0,0,1,0|0,0,0]=1 140 B8R1.7 O=C(O)[C@@H]1CCNC1 SPC-n752 [0,0,0,0,1,0|1,0,0]=2 141 B8R1.7 O=C(O)[C@@H]1CCNC1 SPC-s684 [0,0,0,0,1,0|1,0,0]=2 142 B8R1.7 O=C(O)[C@@H]1CCOC1 SPC-h613 [0,0,0,0,1,0|1,0,0]=2 143 B8R1.7 O=C(O)[C@H]1CCNC1 SPC-g474 [0,0,0,0,1,0|1,0,0]=2 144 B8R1.7 O=C(O)[C@H]1CCNC1 SPC-j200 [0,0,0,0,1,0|1,0,0]=2 145 B8R1.7 O=C(O)[C@H]1CCNC1 SPC-t662 [0,0,0,0,1,0|1,0,0]=2 146 B8R1.7 O=C(O)[C@H]1CCOC1 SPC-g501 [0,0,0,0,1,0|1,0,0]=2 147 B8R1.7 O=C(O)[C@H]1CCOC1 SPC-j337 [0,0,0,0,1,0|1,0,0]=2 148 B10R1.18 O=C(O)CC1CCNCC1 SPC-k739 [0,0,0,0,0,1|1,0,0]=2 149 B10R1.18 O=C(O)CC1CCOCC1 SPC-g717 [0,0,0,0,0,1|1,0,0]=2 150 B10R1.18 O=C(O)C[C@H]1CCCNC1 SPC-j408 [0,0,0,0,0,1|1,0,0]=2 151 B10R1.348 O=C(O)[C@H]1CCCNCC1 SPC-j201 [0,0,0,0,0,1|0,0,0]=1 152 B7R1.3 BrC1CCOCC1 SPC-g434 [2,0,0,0,0,0|2,0,0]=4 153 B7R1.3 C=C1CCOCC1 SPC-m646 [2,0,0,0,0,0|1,0,1]=4 154 B7R1.3 FC1CCNCC1 SPC-g555 [2,0,0,0,0,0|2,0,0]=4 155 B7R1.3 F[C@@H]1CCCNC1 SPC-i353 [2,0,0,0,0,0|2,0,0]=4 156 B7R1.3 F[C@H]1CCCNC1 SPC-i164 [2,0,0,0,0,0|2,0,0]=4 157 B7R1.3 F[C@H]1CCCNC1 SPC-j119 [2,0,0,0,0,0|2,0,0]=4 158 B7R1.3 IC1CCOCC1 SPC-g782 [2,0,0,0,0,0|2,0,0]=4 159 B7R1.3 NC1CCOCC1 SPC-g166 [2,0,0,0,0,0|2,0,0]=4 160 B7R1.3 NC1CCSCC1 SPC-a111 [2,0,0,0,0,0|2,0,0]=4 161 B7R1.3 N[C@@H]1CCCOC1 SPC-s681 [2,0,0,0,0,0|2,0,0]=4 162 B7R1.3 N[C@H]1CCCOC1 SPC-n767 [2,0,0,0,0,0|2,0,0]=4 163 B7R1.3 O=C1CCCNC1 SPC-q237 [2,0,0,0,0,0|1,0,1]=4 164 B7R1.3 O=C1CCCOC1 SPC-g865 [2,0,0,0,0,0|1,0,1]=4 165 B7R1.3 O=C1CCCSC1 SPC-k221 [2,0,0,0,0,0|1,0,1]=4 166 B7R1.3 O=C1CCOCC1 SPC-g072 [2,0,0,0,0,0|1,0,1]=4 167 B7R1.3 O=C1CCSCC1 SPC-g130 [2,0,0,0,0,0|1,0,1]=4 168 B7R1.3 OC1CCOCC1 SPC-g695 [2,0,0,0,0,0|1,0,0]=3 169 B7R1.3 O[C@@H]1CCCNC1 SPC-j185 [2,0,0,0,0,0|1,0,0]=3 170 B7R1.3 O[C@@H]1CCCOC1 SPC-u362 [2,0,0,0,0,0|1,0,0]=3 171 B7R1.3 O[C@H]1CCCNC1 SPC-g006 [2,0,0,0,0,0|1,0,0]=3 172 B7R1.3 O[C@H]1CCCNC1 SPC-g045 [2,0,0,0,0,0|1,0,0]=3 173 B7R1.3 O[C@H]1CCCNC1 SPC-h058 [2,0,0,0,0,0|1,0,0]=3 174 B7R1.3 O[C@H]1CCCOC1 SPC-h213 [2,0,0,0,0,0|1,0,0]=3 175 B7R1.3 O[C@H]1CCCOC1 SPC-u595 [2,0,0,0,0,0|1,0,0]=3 176 B7R1.3 SC1CCNCC1 SPC-m332 [2,0,0,0,0,0|1,1,0]=4 177 B7R1.3 S[C@H]1CCCNC1 SPC-n485 [2,0,0,0,0,0|1,1,0]=4 178 B9R1.1 C#C[C@H]1CC[C@H](O)CC1 SPC-u925 [1,1,0,0,0,0|1,0,1]=4 179 B9R1.1 CC1CCC(CO)CN1 SPC-n810 [1,1,0,0,0,0|1,0,1]=4 180 B9R1.1 CN1CCC(CO)CC1 SPC-g352 [1,1,0,0,0,0|1,0,1]=4 181 B9R1.1 CN[C@H]1CC[C@@H](O)CC1 SPC-m222 [1,1,0,0,0,0|2,0,0]=4 182 B9R1.1 CN[C@H]1CC[C@H](O)CC1 SPC-m223 [1,1,0,0,0,0|2,0,0]=4 183 B9R1.1 CO[C@H]1CC[C@H](N)CC1 SPC-t444 [1,1,0,0,0,0|2,0,0]=4 184 B9R1.1 NC[C@H]1CC[C@@H](O)CC1 SPC-p950 [1,1,0,0,0,0|1,0,1]=4 185 B9R1.1 NC[C@H]1CC[C@H](O)CC1 SPC-j864 [1,1,0,0,0,0|1,0,1]=4 186 B9R1.2 CN1CCC[C@@H](CO)C1 SPC-m829 [1,1,0,0,0,0|1,0,1]=4 187 B9R1.2 CN1CCC[C@H](CO)C1 SPC-r041 [1,1,0,0,0,0|1,0,1]=4 188 B9R1.2 COC1CCCC(O)C1 SPC-q771 [1,1,0,0,0,0|2,0,0]=4 189 B9R1.2 CO[C@@H]1CCC[C@H](O)C1 SPC-v039 [1,1,0,0,0,0|2,0,0]=4 190 B9R1.8 CNCC1CCCCC1 SPC-v381 [1,1,0,0,0,0|1,0,1]=4 191 B9R1.8 COCC1CCNCC1 SPC-h312 [1,1,0,0,0,0|1,0,1]=4 192 B9R1.8 OCCC1CCNCC1 SPC-u123 [1,1,0,0,0,0|1,0,1]=4 193 B9R1.8 OCCC1CCOCC1 SPC-h171 [1,1,0,0,0,0|1,0,1]=4 194 B9R1.8 OCC[C@@H]1CCCCN1 SPC-s721 [1,1,0,0,0,0|1,0,1]=4 195 B9R1.15 OC[C@@H]1CCNC[C@@H]1O SPC-t148 [1,1,0,0,0,0|1,0,1]=4 196 B9R1.15 OC[C@H]1CCNC[C@@H]1O SPC-t376 [1,1,0,0,0,0|1,0,1]=4 197 B9R1.15 OC[C@H]1CCNC[C@H]1F SPC-k013 [1,1,0,0,0,0|1,0,1]=4 198 B9R1.118 CC1(C=O)CCOCC1 SPC-g984 [1,1,0,0,0,0|1,0,0]=3 199 B9R1.118 CC1(CO)CCNCC1 SPC-n785 [1,1,0,0,0,0|1,0,1]=4 200 B9R1.118 C[C@]1(CO)CCCNC1 SPC-k841 [1,1,0,0,0,0|1,0,1]=4 201 B9R1.118 NC1(CO)CCOCC1 SPC-m016 [1,1,0,0,0,0|1,0,1]=4 202 B9R1.118 NC1(CO)CCOCC1 SPC-m017 [1,1,0,0,0,0|1,0,1]=4 203 B9R1.118 OCC1(F)CCNCC1 SPC-j549 [1,1,0,0,0,0|1,0,1]=4 204 B9R1.118 OCC1(F)CCOCC1 SPC-m018 [1,1,0,0,0,0|1,0,1]=4 205 B9R1.118 OCC1(O)CCNCC1 SPC-j551 [1,1,0,0,0,0|1,0,1]=4 206 B9R1.11 COC(=O)C1CC=CC1 SPC-n455 [0,1,0,0,1,0|0,0,2]=4 207 B9R1.11 COC(=O)[C@@H]1CCNC1 SPC-j204 [0,1,0,0,1,0|1,0,0]=3 208 B9R1.11 COC(=O)[C@@H]1CCNC1 SPC-j205 [0,1,0,0,1,0|1,0,0]=3 209 B9R1.11 COC(=O)[C@@H]1CCOC1 SPC-h930 [0,1,0,0,1,0|1,0,0]=3 210 B9R1.11 COC(=O)[C@H]1CCNC1 SPC-g645 [0,1,0,0,1,0|1,0,0]=3 211 B9R1.11 COC(=O)[C@H]1CCNC1 SPC-j202 [0,1,0,0,1,0|1,0,0]=3 212 B9R1.11 COC(=O)[C@H]1CCNC1 SPC-j203 [0,1,0,0,1,0|1,0,0]=3 213 B9R1.11 COC(=O)[C@H]1CCOC1 SPC-j338 [0,1,0,0,1,0|1,0,0]=3 214 B9R1.11 COC(=O)[C@H]1CCOC1 SPC-q074 [0,1,0,0,1,0|1,0,0]=3 215 B9R1.19 O=S(=O)(O)C1CCCC1 SPC-k318 [0,1,0,0,1,0|1,0,0]=3 216 B9R1.35 CC(=O)N1CC[C@@H](O)C1 SPC-k184 [0,1,0,0,1,0|2,0,0]=4 217 B9R1.35 CC(=O)N1CC[C@H](N)C1 SPC-u453 [0,1,0,0,1,0|2,0,0]=4 218 B9R1.35 CN1CC[C@@H](C(=O)O)C1 SPC-v096 [0,1,0,0,1,0|1,0,0]=3 219 B9R1.35 CN1CC[C@H](C(=O)O)C1 SPC-k848 [0,1,0,0,1,0|1,0,0]=3 220 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)N1 SPC-s049 [0,1,0,0,1,0|1,0,0]=3 221 B9R1.35 C[C@H]1CC[C@H](C(=O)O)N1 SPC-s038 [0,1,0,0,1,0|1,0,0]=3 222 B9R1.35 NC1CCC(C(=O)O)C1 SPC-h180 [0,1,0,0,1,0|0,0,0]=2 223 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 SPC-q476 [0,1,0,0,1,0|0,0,0]=2 224 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 SPC-t661 [0,1,0,0,1,0|0,0,0]=2 225 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 SPC-j914 [0,1,0,0,1,0|1,0,0]=3 226 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 SPC-j915 [0,1,0,0,1,0|1,0,0]=3 227 B9R1.35 O=C(O)[C@@H]1C[C@@H](S)CN1 SPC-s047 [0,1,0,0,1,0|1,0,0]=3 228 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 SPC-k019 [0,1,0,0,1,0|1,0,0]=3 229 B9R1.35 O=C(O)[C@@H]1C[C@H](S)CN1 SPC-s048 [0,1,0,0,1,0|1,0,0]=3 230 B9R1.35 O=C(O)[C@H]1C[C@@H](F)CN1 SPC-n707 [0,1,0,0,1,0|1,0,0]=3 231 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 SPC-g127 [0,1,0,0,1,0|1,0,0]=3 232 B9R1.35 O=C(O)[C@H]1C[C@H](F)CN1 SPC-k011 [0,1,0,0,1,0|1,0,0]=3 233 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 SPC-m778 [0,1,0,0,1,0|1,0,0]=3 234 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 SPC-t597 [0,1,0,0,1,0|1,0,0]=3 235 B9R1.35 O=C1CC[C@@H](C(=O)O)C1 SPC-h594 [0,1,0,0,1,0|0,0,1]=3 236 B9R1.35 O=C1CC[C@@H](C(=O)O)O1 SPC-g806 [0,1,0,0,1,0|1,0,1]=4 237 B9R1.35 O=C1CC[C@@H](C(=O)O)S1 SPC-p725 [0,1,0,0,1,0|1,0,1]=4 238 B9R1.35 O=C1CC[C@H](C(=O)O)C1 SPC-h678 [0,1,0,0,1,0|0,0,1]=3 239 B9R1.35 O=C1CC[C@H](C(=O)O)C1 SPC-k770 [0,1,0,0,1,0|0,0,1]=3 240 B9R1.35 O=C1CN[C@H](C(=O)O)C1 SPC-k492 [0,1,0,0,1,0|1,0,1]=4 241 B9R1.35 O=C1C[C@H](C(=O)O)CN1 SPC-j969 [0,1,0,0,1,0|1,0,1]=4 242 B9R1.41 CN1CCC[C@@H]1C(=O)O SPC-m779 [0,1,0,0,1,0|1,0,0]=3 243 B9R1.41 CN1CCC[C@H]1C(=O)O SPC-h222 [0,1,0,0,1,0|1,0,0]=3 244 B9R1.41 O=C(O)[C@@H]1CCNC1=O SPC-n002 [0,1,0,0,1,0|1,0,1]=4 245 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O SPC-h688 [0,1,0,0,1,0|1,0,0]=3 246 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O SPC-j849 [0,1,0,0,1,0|1,0,0]=3 247 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O SPC-k415 [0,1,0,0,1,0|1,0,0]=3 248 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O SPC-u455 [0,1,0,0,1,0|1,0,0]=3 249 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O SPC-k017 [0,1,0,0,1,0|1,0,0]=3 250 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O SPC-k959 [0,1,0,0,1,0|1,0,0]=3 251 B9R1.163 C[C@@]1(C(=O)O)CCCN1 SPC-g584 [0,1,0,0,1,0|1,0,0]=3 252 B9R1.163 C[C@]1(C(=O)O)CCCN1 SPC-g857 [0,1,0,0,1,0|1,0,0]=3 253 B9R1.163 C[C@]1(C(=O)O)CCOC1 SPC-m235 [0,1,0,0,1,0|1,0,0]=3 254 B9R1.163 N[C@@]1(C(=O)O)CCNC1 SPC-t675 [0,1,0,0,1,0|1,0,0]=3 255 B9R1.163 N[C@@]1(C(=O)O)CCOC1 SPC-m540 [0,1,0,0,1,0|1,0,0]=3 256 B9R1.163 O=C(O)[C@]1(F)CCNC1 SPC-r282 [0,1,0,0,1,0|1,0,0]=3 257 B11R1.20 CN1CCC(CC(=O)O)CC1 SPC-k732 [0,1,0,0,0,1|1,0,0]=3 258 B11R1.36 CC(=O)N(C)[C@@H]1CCCNC1 SPC-q221 [0,1,0,0,0,1|2,0,0]=4 259 B11R1.36 CC(=O)N(C)[C@H]1CCCNC1 SPC-q217 [0,1,0,0,0,1|2,0,0]=4 260 B11R1.36 CC(=O)N(C)[C@H]1CCCNC1 SPC-u072 [0,1,0,0,0,1|2,0,0]=4 261 B11R1.36 N[C@H](C(=O)O)C1CCOCC1 SPC-m555 [0,1,0,0,0,1|1,0,0]=3 262 B11R1.928 O=C(O)CC1(O)CCNCC1 SPC-o012 [0,1,0,0,0,1|1,0,0]=3 263 B11R1.928 O=C(O)C[C@]1(O)CCCNC1 SPC-o011 [0,1,0,0,0,1|1,0,0]=3 264 B11R1.852 COC(=O)[C@H]1CCCNCC1 SPC-h650 [0,1,0,0,0,1|0,0,0]=2 265 B11R1.3 CC(=O)N1CCC(CN)CC1 SPC-p922 [0,2,0,0,0,0|2,0,0]=4 266 B11R1.3 CC(=O)N1CCC(CO)CC1 SPC-n960 [0,2,0,0,0,0|2,0,0]=4 267 B11R1.3 CCC1CCC(C(=O)O)CC1 SPC-u328 [0,2,0,0,0,0|0,0,0]=2 268 B11R1.3 CO[C@H]1CC[C@@H](C(=O)O)CC1 SPC-t150 [0,2,0,0,0,0|0,0,0]=2 269 B11R1.3 CO[C@H]1CC[C@H](C(=O)O)CC1 SPC-k560 [0,2,0,0,0,0|0,0,0]=2 270 B11R1.3 O=CN1CCC(C(=O)O)CC1 SPC-k189 [0,2,0,0,0,0|1,0,0]=3 271 B11R1.19 CC(C)(O)[C@H]1CC[C@H](N)CC1 SPC-m943 [0,2,0,0,0,0|1,0,1]=4 272 B11R1.21 CN1CC[C@H](C(=O)O)CC1=O SPC-h068 [0,2,0,0,0,0|1,0,1]=4 273 B11R1.21 CN1C[C@@H](C(=O)O)CCC1=O SPC-s783 [0,2,0,0,0,0|1,0,1]=4 274 B11R1.22 CC1CCN(C(=O)CCl)CC1 SPC-u715 [0,2,0,0,0,0|2,0,0]=4 275 B11R1.22 COC(=O)[C@@H]1CC[C@@H](C)NC1 SPC-m680 [0,2,0,0,0,0|1,0,0]=3 276 B11R1.22 COC(=O)[C@@H]1CC[C@@H](C)NC1 SPC-q473 [0,2,0,0,0,0|1,0,0]=3 277 B11R1.22 COC(=O)[C@@H]1CC[C@H](C)NC1 SPC-q174 [0,2,0,0,0,0|1,0,0]=3 278 B11R1.22 COC(=O)[C@@H]1CC[C@H](C)NC1 SPC-q518 [0,2,0,0,0,0|1,0,0]=3 279 B11R1.22 COC(=O)[C@H]1CCC(=O)NC1 SPC-h278 [0,2,0,0,0,0|1,0,1]=4 280 B11R1.22 COC(=O)[C@H]1CC[C@H](C)NC1 SPC-v302 [0,2,0,0,0,0|1,0,0]=3 281 B11R1.22 COC(=O)[C@H]1CC[C@H](O)CC1 SPC-g639 [0,2,0,0,0,0|0,0,0]=2 282 B11R1.166 C[C@@H]1CC(=O)CC[C@H]1C(=O)O SPC-u978 [0,2,0,0,0,0|0,0,1]=3 283 B11R1.166 C[C@H]1CC(=O)CC[C@H]1C(=O)O SPC-u940 [0,2,0,0,0,0|0,0,1]=3 284 B11R1.220 CN1CCC(C)(C(=O)O)CC1 SPC-v031 [0,2,0,0,0,0|1,0,0]=3 285 B11R1.727 O=C(O)C1CCC(F)(F)CC1 SPC-g600 [0,2,0,0,0,0|0,0,0]=2 286 B11R1.727 O=C(O)C1CCS(=O)(=O)CC1 SPC-a113 [0,2,0,0,0,0|1,0,0]=3 287 B11R1.727 O=C(O)[C@@H]1CCC(F)(F)CN1 SPC-k188 [0,2,0,0,0,0|1,0,0]=3 288 B11R1.16 CCOC(=O)N1CCNCC1 SPC-t185 [0,2,0,0,0,0|2,0,0]=4 289 B11R1.16 CCOC(=O)[C@@H]1CNCCN1 SPC-t477 [0,2,0,0,0,0|2,0,0]=4 290 B11R1.16 CCOC(=O)[C@@H]1COCCN1 SPC-f087 [0,2,0,0,0,0|2,0,0]=4 291 B11R1.16 CCOC(=O)[C@@H]1CSCCN1 SPC-f062 [0,2,0,0,0,0|2,0,0]=4 292 B11R1.16 N#CCC(=O)C1CCOCC1 SPC-j559 [0,2,0,0,0,0|2,0,0]=4 293 B11R1.23 COC(=O)C1CNCC(C)C1 SPC-n448 [0,2,0,0,0,0|1,0,0]=3 294 B11R1.23 COC(=O)[C@@H]1CC(=O)CCN1 SPC-u651 [0,2,0,0,0,0|1,0,1]=4 295 B11R1.23 COC(=O)[C@@H]1CCC[C@H](O)C1 SPC-t643 [0,2,0,0,0,0|0,0,0]=2 296 B11R1.23 COC(=O)[C@@H]1CCC[C@H](O)C1 SPC-v329 [0,2,0,0,0,0|0,0,0]=2 297 B11R1.23 COC(=O)[C@@H]1COCC(=O)C1 SPC-t469 [0,2,0,0,0,0|1,0,1]=4 298 B11R1.23 COC(=O)[C@H]1CCC[C@@H](O)C1 SPC-u846 [0,2,0,0,0,0|0,0,0]=2 299 B11R1.23 COC(=O)[C@H]1CCC[C@H](N)C1 SPC-v379 [0,2,0,0,0,0|0,0,0]=2 300 B11R1.23 COC(=O)[C@H]1CCNC(=O)C1 SPC-h340 [0,2,0,0,0,0|1,0,1]=4 301 B11R1.23 COC(=O)[C@H]1CNC[C@@H](C)C1 SPC-q176 [0,2,0,0,0,0|1,0,0]=3 302 B11R1.222 COC(=O)C1CCNCC1C SPC-u487 [0,2,0,0,0,0|1,0,0]=3 303 B11R1.222 COC(=O)C1CCNCC1F SPC-q117 [0,2,0,0,0,0|1,0,0]=3 304 B11R1.222 COC(=O)[C@@H]1COCCC1=O SPC-u726 [0,2,0,0,0,0|1,0,1]=4 305 B11R1.878 CNC(=O)C1(N)CCOCC1 SPC-t465 [0,2,0,0,0,0|2,0,0]=4 306 B11R1.878 COC(=O)C1(C)CCNCC1 SPC-m561 [0,2,0,0,0,0|1,0,0]=3 307 B11R1.878 COC(=O)C1(C)CCOCC1 SPC-m013 [0,2,0,0,0,0|1,0,0]=3 308 B11R1.878 COC(=O)C1(F)CCOCC1 SPC-m063 [0,2,0,0,0,0|1,0,0]=3 309 B11R1.878 COC(=O)C1(N)CCOCC1 SPC-g897 [0,2,0,0,0,0|1,0,0]=3 310 B11R1.878 COC(=O)C1(N)CCOCC1 SPC-q125 [0,2,0,0,0,0|1,0,0]=3 311 B11R1.878 COC(=O)C1(O)CCNCC1 SPC-t549 [0,2,0,0,0,0|1,0,0]=3 312 B11R1.878 COC(=O)C1(O)CCOCC1 SPC-h184 [0,2,0,0,0,0|1,0,0]=3 313 B11R1.878 COC(=O)[C@@]1(C)CCCNC1 SPC-k844 [0,2,0,0,0,0|1,0,0]=3 314 B11R1.878 COC(=O)[C@]1(C)CCCCN1 SPC-r056 [0,2,0,0,0,0|1,0,0]=3 315 B11R1.878 COC(=O)[C@]1(C)COCCN1 SPC-j922 [0,2,0,0,0,0|2,0,0]=4 316 B11R1.177 CC1(C)OCCO[C@@H]1C(=O)O SPC-v524 [0,2,0,0,0,0|2,0,0]=4 317 B11R1.177 CC1(C)SCCN[C@@H]1C(=O)O SPC-p425 [0,2,0,0,0,0|2,0,0]=4 318 B11R1.177 O=C(O)[C@H]1CCNCC1(F)F SPC-u624 [0,2,0,0,0,0|1,0,0]=3 319 B11R1.1074 COC1(C(=O)O)CCNCC1 SPC-r046 [0,2,0,0,0,0|1,0,0]=3 320 B9R1.13 O=C(O)CC1CCCC1 SPC-k446 [0,0,1,1,0,0|0,0,0]=2 321 B9R1.13 O=C(O)C[C@@H]1CCNC1 SPC-s817 [0,0,1,1,0,0|1,0,0]=3 322 B9R1.13 O=C(O)C[C@H]1CCNC1 SPC-j407 [0,0,1,1,0,0|1,0,0]=3 323 B9R1.13 O=C(O)C[C@H]1CCOC1 SPC-v310 [0,0,1,1,0,0|1,0,0]=3 324 B9R1.84 O=C(O)CNC1COC1 SPC-a298 [0,0,1,1,0,0|2,0,0]=4 325 B9R1.84 O=C(O)\C=C\C1CCC1 SPC-u812 [0,0,1,1,0,0|0,0,2]=4 326 B9R1.96 CCC1CN[C@@H]1C(=O)O SPC-p137 [0,0,1,1,0,0|1,0,0]=3 327 B9R1.96 CCN1CC[C@H]1C(=O)O SPC-p134 [0,0,1,1,0,0|1,0,0]=3 328 B9R1.96 N#CC1CCC1C(=O)O SPC-p215 [0,0,1,1,0,0|1,0,1]=4 329 B9R1.95 COC1CC(C(=O)O)C1 SPC-i683 [0,0,1,1,0,0|1,0,0]=3 330 B9R1.95 CO[C@H]1C[C@@H](C(=O)O)C1 SPC-i655 [0,0,1,1,0,0|1,0,0]=3 331 B9R1.95 CO[C@H]1C[C@H](C(=O)O)C1 SPC-i033 [0,0,1,1,0,0|1,0,0]=3 332 B9R1.95 NCC1CC(C(=O)O)C1 SPC-m330 [0,0,1,1,0,0|1,0,0]=3 333 B9R1.110 N[C@@H](C(=O)O)C1CCC1 SPC-j771 [0,0,1,1,0,0|1,0,0]=3 334 B9R1.110 N[C@@H](C(=O)O)C1COC1 SPC-i747 [0,0,1,1,0,0|2,0,0]=4 335 B9R1.110 N[C@H](C(=O)O)C1CCC1 SPC-h873 [0,0,1,1,0,0|1,0,0]=3 336 B9R1.110 N[C@H](C(=O)O)C1CCC1 SPC-h964 [0,0,1,1,0,0|1,0,0]=3 337 B9R1.110 N[C@H](C(=O)O)C1COC1 SPC-i177 [0,0,1,1,0,0|2,0,0]=4 338 B9R1.110 N[C@H](C(=O)O)C1COC1 SPC-i947 [0,0,1,1,0,0|2,0,0]=4 339 B9R1.112 NC(=O)[C@@H](N)CC1CC1 SPC-v428 [0,0,1,1,0,0|2,0,0]=4 340 B9R1.112 N[C@@H](CC1CC1)C(=O)O SPC-u403 [0,0,1,1,0,0|1,0,0]=3 341 B9R1.119 CCC1(C(=O)O)COC1 SPC-h341 [0,0,1,1,0,0|1,0,0]=3 342 B9R1.119 CC[C@@]1(C(=O)O)CCO1 SPC-v336 [0,0,1,1,0,0|1,0,0]=3 343 B9R1.119 COC1(C(=O)O)CNC1 SPC-i682 [0,0,1,1,0,0|2,0,0]=4 344 B9R1.119 N#CC1(C(=O)O)CCC1 SPC-t591 [0,0,1,1,0,0|1,0,1]=4 345 B9R1.119 NCC1(C(=O)O)CCC1 SPC-t495 [0,0,1,1,0,0|1,0,0]=3 346 B9R1.179 C=CCC1(C(=O)O)CC1 SPC-q811 [0,0,1,1,0,0|0,0,2]=4 347 B9R1.179 COCC1(C(=O)O)CC1 SPC-n909 [0,0,1,1,0,0|1,0,0]=3 348 B9R1.179 NCCC1(C(=O)O)CC1 SPC-k073 [0,0,1,1,0,0|1,0,0]=3 349 B9R1.179 NCCC1(C(=O)O)CC1 SPC-q540 [0,0,1,1,0,0|1,0,0]=3 350 B9R1.179 O=C(O)C1(CCCl)CC1 SPC-q812 [0,0,1,1,0,0|1,0,0]=3 351 B9R2.49 C1CC2CCC1CN2 SPC-m957 [1,0,0,1,0,0|1,0,1]=4 352 B9R2.53 O=C1C2CNCC1C2 SPC-i426 [1,0,0,1,0,0|1,0,0]=3 353 B9R2.53 OC1C2CNCC1C2 SPC-i414 [1,0,0,1,0,0|1,0,1]=4 354 B9R2.56 OCC12CNCC1C2 SPC-p326 [1,0,0,1,0,0|1,0,1]=4 355 B9R2.56 OCC12CNCC1C2 SPC-s909 [1,0,0,1,0,0|1,0,1]=4 356 B9R2.123 NC1C2CCCCC12 SPC-v263 [1,0,0,1,0,0|1,0,1]=4 357 B9R2.148 O=C(O)C1C2CCC21 SPC-w002 [0,0,0,1,1,0|0,0,0]=2 358 B11R2.10 O=C1NC2CCNCC2O1 SPC-t519 [0,0,0,1,0,1|1,0,0]=3 359 B11R2.703 O=C1CC2(CCCCC2)C1 SPC-b342 [0,0,0,1,0,1|1,0,0]=3 360 B11R2.703 O=C1CC2(CCNCC2)N1 SPC-s118 [0,0,0,1,0,1|2,0,0]=4 361 B11R2.703 O=C1CC2(CCOCC2)C1 SPC-b279 [0,0,0,1,0,1|2,0,0]=4 362 B11R2.703 O=C1C[C@]2(CCCNC2)N1 SPC-u825 [0,0,0,1,0,1|2,0,0]=4 363 B11R2.1824 CC(=O)N1C2CNCC1C2 SPC-v117 [0,0,0,1,0,1|2,0,0]=4 364 B11R2.813 O=C(O)C12CC1CCCN2 SPC-s225 [0,0,0,1,0,1|0,0,0]=2 365 B11R2.1837 O=C(O)C1NCCC2CC21 SPC-v678 [0,0,0,1,0,1|0,0,0]=2 366 B11R2.1839 NC(=O)C12CCC(CC1)C2 SPC-a482 [0,1,0,1,0,0|1,0,0]=3 367 B11R2.1839 O=C(O)C12CCC(CC1)C2 SPC-a486 [0,1,0,1,0,0|0,0,0]=2 368 B11R2.12 O=C1CCC12CCCCC2 SPC-b343 [0,1,0,1,0,0|1,0,0]=3 369 B11R2.12 O=C1CCC12CCOCC2 SPC-b346 [0,1,0,1,0,0|2,0,0]=4 370 B11R2.12 O=C1COC12CCCCC2 SPC-b268 [0,1,0,1,0,0|0,0,0]=2 371 B11R2.12 O=C1NCC12CCNCC2 SPC-i964 [0,1,0,1,0,0|2,0,0]=4 372 B11R2.12 O=C1NC[C@@]12CCCNC2 SPC-v056 [0,1,0,1,0,0|2,0,0]=4 373 B11R2.12 O[C@H]1CCC12CCCCC2 SPC-u816 [0,1,0,1,0,0|1,0,1]=4 374 B11R2.895 COC(=O)C12CNCC1C2 SPC-s285 [0,1,0,1,0,0|1,0,0]=3 375 B11R2.914 COC(=O)C1CC2OC2C1 SPC-j968 [0,1,0,1,0,0|1,0,0]=3 376 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@@H]1C2 SPC-q716 [0,1,0,1,0,0|1,0,0]=3 377 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@@H]1C2 SPC-u992 [0,1,0,1,0,0|1,0,0]=3 378 B11R2.845 O=C(O)[C@H]1N[C@@H]2CC[C@H]1C2 SPC-q715 [0,1,0,1,0,0|1,0,0]=3 379 B11R2.846 CC(=O)N1CC2CC(C1)N2 SPC-v532 [0,1,0,1,0,0|2,0,0]=4 380 B11R2.1826 NC(=O)C12CCCC(C1)C2 SPC-a531 [0,1,0,1,0,0|1,0,0]=3 381 B11R2.1826 O=C(O)C12CC(CCN1)C2 SPC-i471 [0,1,0,1,0,0|1,0,0]=3 382 B11R2.1826 O=C(O)C12CCCC(C1)C2 SPC-a528 [0,1,0,1,0,0|0,0,0]=2 383 B7R1.1 BrCC1CCCC1 SPC-s715 [1,0,0,0,1,0|1,0,1]=4 384 B7R1.1 NCC1CCCC1 SPC-k191 [1,0,0,0,1,0|1,0,1]=4 385 B7R1.1 NCC1CCCC1 SPC-t893 [1,0,0,0,1,0|1,0,1]=4 386 B7R1.1 OC[C@@H]1CCCN1 SPC-g330 [1,0,0,0,1,0|1,0,1]=4 387 B7R1.1 OC[C@@H]1CCNC1 SPC-k806 [1,0,0,0,1,0|1,0,1]=4 388 B7R1.1 OC[C@@H]1CCNC1 SPC-n751 [1,0,0,0,1,0|1,0,1]=4 389 B7R1.1 OC[C@@H]1CCOC1 SPC-h734 [1,0,0,0,1,0|1,0,1]=4 390 B7R1.1 OC[C@H]1CCCN1 SPC-m785 [1,0,0,0,1,0|1,0,1]=4 391 B7R1.1 OC[C@H]1CCNC1 SPC-k804 [1,0,0,0,1,0|1,0,1]=4 392 B7R1.1 OC[C@H]1CCNC1 SPC-k805 [1,0,0,0,1,0|1,0,1]=4 393 B7R1.1 OC[C@H]1CCNC1 SPC-n768 [1,0,0,0,1,0|1,0,1]=4 394 B7R1.1 OC[C@H]1CCOC1 SPC-j339 [1,0,0,0,1,0|1,0,1]=4 395 B7R1.1 OC[C@H]1CCOC1 SPC-n475 [1,0,0,0,1,0|1,0,1]=4 396 B7R1.18 CC(=O)C1CCC1 SPC-h776 [0,0,0,0,2,0|1,0,0]=3 397 B7R1.18 CC(=O)C1COC1 SPC-r005 [0,0,0,0,2,0|2,0,0]=4 398 B7R1.18 C[C@H](O)C1CCC1 SPC-u195 [0,0,0,0,2,0|1,0,1]=4 399 B7R1.18 N=C(N)C1CCC1 SPC-h880 [0,0,0,0,2,0|2,0,0]=4 400 B7R1.18 NC(=O)C1CNC1 SPC-h816 [0,0,0,0,2,0|2,0,0]=4 401 B7R1.18 O=C(O)C1CCC1 SPC-a107 [0,0,0,0,2,0|0,0,0]=2 402 B7R1.18 O=C(O)C1CNC1 SPC-g671 [0,0,0,0,2,0|1,0,0]=3 403 B7R1.18 O=C(O)C1COC1 SPC-a017 [0,0,0,0,2,0|1,0,0]=3 404 B7R1.18 O=C(O)C1CSC1 SPC-a106 [0,0,0,0,2,0|1,0,0]=3 405 B7R1.18 O=C(O)[C@@H]1CCN1 SPC-g935 [0,0,0,0,2,0|1,0,0]=3 406 B7R1.18 O=C(O)[C@@H]1CCN1 SPC-h064 [0,0,0,0,2,0|1,0,0]=3 407 B7R1.18 O=C(O)[C@@H]1CCO1 SPC-a304 [0,0,0,0,2,0|1,0,0]=3 408 B7R1.18 O=C(O)[C@@H]1CCO1 SPC-u910 [0,0,0,0,2,0|1,0,0]=3 409 B7R1.18 O=C(O)[C@H]1CCN1 SPC-h200 [0,0,0,0,2,0|1,0,0]=3 410 B7R1.18 O=C(O)[C@H]1CCO1 SPC-u911 [0,0,0,0,2,0|1,0,0]=3 411 B9R1.89 CO[C@H]1CCCNCC1 SPC-h967 [1,0,0,0,0,1|2,0,0]=4 412 B9R1.89 CO[C@H]1CCCNCC1 SPC-j078 [1,0,0,0,0,1|2,0,0]=4 413 B9R1.89 N#C[C@H]1CCCNCC1 SPC-n307 [1,0,0,0,0,1|1,0,1]=4