0 B6R0.6 BrCCNCCBr CS-D1601 [0,0,0,0,0,0|3,0,0]=3 1 B6R0.6 C#CCCCC#N CS-0196806 [0,0,0,0,0,0|1,0,3]=4 2 B6R0.6 C#CCCCCBr CS-0248001 [0,0,0,0,0,0|1,0,2]=3 3 B6R0.6 C#CCCNCC CS-0891938 [0,0,0,0,0,0|2,0,1]=3 4 B6R0.6 CCCCCCO CS-0076046 [0,0,0,0,0,0|0,1,0]=1 5 B6R0.6 NCCOCCN CS-W006284 [0,0,0,0,0,0|3,0,0]=3 6 B6R0.6 NCCOCCS CS-0115806 [0,0,0,0,0,0|2,0,0]=2 7 B6R0.6 [N-]=[N+]=NCCCBr CS-0567271 [0,0,0,0,0,0|4,0,0]=4 8 B5R0.2 C#CCCNC CS-0891238 [1,0,0,0,0,0|1,0,2]=4 9 B5R0.2 C=CCCCO CS-W011355 [1,0,0,0,0,0|0,1,2]=4 10 B5R0.2 N#CCCCN CS-0343605 [1,0,0,0,0,0|2,0,1]=4 11 B5R0.2 N#CCCCO CS-W001264 [1,0,0,0,0,0|1,1,1]=4 12 B7R0.1 C#CCCCCCN CS-0864774 [0,1,0,0,0,0|1,0,1]=3 13 B7R0.1 C=CCCCCCO CS-0185704 [0,1,0,0,0,0|0,1,1]=3 14 B7R0.1 COCCOCCO CS-0116091 [0,1,0,0,0,0|1,1,0]=3 15 B7R0.1 OCCSSCCO CS-0113483 [0,1,0,0,0,0|2,1,0]=4 16 B7R0.1 [N-]=[N+]=NCCCCBr CS-0614388 [0,1,0,0,0,0|3,0,0]=4 17 B7R0.3 C=CCC[C@@H](O)CCl CS-0374305 [0,1,0,0,0,0|1,0,2]=4 18 B7R0.3 CCCN[C@H](C)CO CS-0626374 [0,1,0,0,0,0|1,1,0]=3 19 B7R0.3 COC(=O)CCCO CS-0042326 [0,1,0,0,0,0|1,1,1]=4 20 B7R0.3 O=C(CBr)CCCBr CS-1172752 [0,1,0,0,0,0|2,0,1]=4 21 B7R0.4 C#CCCCN(C)C CS-0966989 [0,1,0,0,0,0|2,0,1]=4 22 B7R0.4 C#CCCNC(C)C CS-0850466 [0,1,0,0,0,0|2,0,1]=4 23 B7R0.4 C=CCCC[C@H](C)O CS-1049849 [0,1,0,0,0,0|1,0,1]=3 24 B7R0.4 CC(=O)CCCCO CS-0514254 [0,1,0,0,0,0|0,1,1]=3 25 B7R0.4 CCCCCC(N)=O CS-0128758 [0,1,0,0,0,0|0,1,1]=3 26 B7R0.4 NCCOCC(F)F CS-0530456 [0,1,0,0,0,0|3,0,0]=4 27 B7R0.4 O=[N+]([O-])CCCCO CS-0198124 [0,1,0,0,0,0|2,1,0]=4 28 B7R0.4 OCCNCC(F)F CS-0265634 [0,1,0,0,0,0|2,1,0]=4 29 B7R0.7 CCC[C@@H](N)CCO CS-0162168 [0,1,0,0,0,0|0,1,0]=2 30 B7R1.1 BrCC1=CCCC1 CS-0052832 [0,0,0,1,0,0|1,0,2]=4 31 B7R1.1 BrC[C@@H]1CCCO1 CS-0310762 [0,0,0,1,0,0|1,1,0]=3 32 B7R1.1 CC[C@@H]1CCCN1 CS-0452663 [0,0,0,1,0,0|1,0,0]=2 33 B7R1.1 CC[C@@H]1CCNC1 CS-0053328 [0,0,0,1,0,0|2,0,0]=3 34 B7R1.1 ClCC1CCCO1 CS-W011203 [0,0,0,1,0,0|1,1,0]=3 35 B7R1.1 FCC1CCNC1 CS-0614521 [0,0,0,1,0,0|2,0,0]=3 36 B7R1.1 N#CC1CCCO1 CS-0063942 [0,0,0,1,0,0|1,1,1]=4 37 B7R1.1 N#C[C@H]1CCCN1 CS-0053948 [0,0,0,1,0,0|2,0,1]=4 38 B7R1.1 NOC1CCCC1 CS-0634533 [0,0,0,1,0,0|2,0,0]=3 39 B7R1.1 OCC1CCCS1 CS-0265065 [0,0,0,1,0,0|1,0,0]=2 40 B7R1.1 OC[C@@H]1CCOC1 CS-0053251 [0,0,0,1,0,0|1,1,0]=3 41 B7R1.3 C=C1CCNCC1 CS-0642791 [0,0,0,1,0,0|2,0,1]=4 42 B7R1.3 CC1=NCCCC1 CS-1176015 [0,0,0,1,0,0|1,0,1]=3 43 B7R1.3 NC1C=CCCC1 CS-0447132 [0,0,0,1,0,0|1,0,2]=4 44 B7R1.3 NC1CCNCC1 CS-0069687 [0,0,0,1,0,0|2,0,0]=3 45 B7R1.3 N[C@H]1CCCNC1 CS-W020063 [0,0,0,1,0,0|2,0,0]=3 46 B7R1.4 C[C@H]1CNC[C@H]1O CS-0036375 [0,0,0,1,0,0|1,1,0]=3 47 B7R1.4 C[C@H]1OCC[C@H]1N CS-0038438 [0,0,0,1,0,0|2,0,0]=3 48 B7R1.4 N[C@@H]1COC[C@@H]1O CS-0139374 [0,0,0,1,0,0|2,1,0]=4 49 B7R1.4 N[C@H]1COC[C@@H]1F CS-0183120 [0,0,0,1,0,0|3,0,0]=4 50 B7R1.4 N[C@H]1COC[C@H]1O CS-0053228 [0,0,0,1,0,0|2,1,0]=4 51 B7R1.4 O[C@H]1CCC[C@H]1O CS-0132323 [0,0,0,1,0,0|1,1,0]=3 52 B7R1.7 OCCOC1CC1 CS-0432950 [0,0,0,1,0,0|1,1,0]=3 53 B6R0.1 CCC(=O)CSC CS-0434652 [1,1,0,0,0,0|1,0,1]=4 54 B6R0.1 CCC(O)CC#N CS-0258400 [1,1,0,0,0,0|1,0,1]=4 55 B6R0.1 CCC(O)CNC CS-0225521 [1,1,0,0,0,0|1,0,0]=3 56 B6R0.1 COC[C@@H](N)CO CS-0201549 [1,1,0,0,0,0|1,1,0]=4 57 B6R0.1 COC[C@H](C)CO CS-0145677 [1,1,0,0,0,0|1,1,0]=4 58 B6R0.1 COC[C@H](N)CO CS-0201548 [1,1,0,0,0,0|1,1,0]=4 59 B6R0.1 NC(CO)CCO CS-0091333 [1,1,0,0,0,0|1,1,0]=4 60 B6R0.1 OC(CBr)CCBr CS-0449071 [1,1,0,0,0,0|2,0,0]=4 61 B6R0.1 OCC[C@@H](Br)CO CS-1141050 [1,1,0,0,0,0|1,1,0]=4 62 B6R0.4 CC(C)CCCN CS-0252871 [1,1,0,0,0,0|1,0,0]=3 63 B6R0.4 CNCCC(C)O CS-0459922 [1,1,0,0,0,0|1,0,0]=3 64 B6R0.4 CSCCC(C)O CS-0242060 [1,1,0,0,0,0|1,0,0]=3 65 B8R0.1 CCCC[C@H](N)CCO CS-0063111 [0,2,0,0,0,0|0,1,0]=3 66 B8R0.1 CCOC(=O)CCCO CS-0539430 [0,2,0,0,0,0|0,1,1]=4 67 B8R0.1 CCOC(=O)CCSC CS-W010980 [0,2,0,0,0,0|1,0,1]=4 68 B8R0.4 C#CCCCCCCC CS-0204456 [0,2,0,0,0,0|1,0,0]=3 69 B8R0.4 C#CCCCCCCN CS-0110134 [0,2,0,0,0,0|1,0,0]=3 70 B8R0.4 C=CCCCCCCCl CS-0158000 [0,2,0,0,0,0|1,0,0]=3 71 B8R0.4 CC\C=C/CCCCO CS-0153943 [0,2,0,0,0,0|0,1,0]=3 72 B8R0.4 COCCOCCON CS-0114359 [0,2,0,0,0,0|1,1,0]=4 73 B8R0.4 NCCCNCCCCl CS-0885982 [0,2,0,0,0,0|1,0,0]=3 74 B8R0.4 [N-]=[N+]=NCCCCCN CS-0567250 [0,2,0,0,0,0|2,0,0]=4 75 B8R0.6 CCCCCC(=O)O[Na] CS-0152338 [0,2,0,0,0,0|0,1,1]=4 76 B8R0.6 OCCCCC(O)CO CS-W013379 [0,2,0,0,0,0|0,1,0]=3 77 B8R0.3 CCCC(O)C(C)CC CS-0872989 [0,2,0,0,0,0|1,0,0]=3 78 B8R0.9 CC(C)NCC(O)CO CS-0454515 [0,2,0,0,0,0|1,1,0]=4 79 B8R0.11 CCCCC(CC)CN CS-W016071 [0,2,0,0,0,0|1,0,0]=3 80 B8R0.11 CCN(CC)CCCCl CS-0103377 [0,2,0,0,0,0|2,0,0]=4 81 B6R1.1 C1C[Se]CCN1 CS-0371384 [1,0,0,1,0,0|1,1,0]=4 82 B6R1.2 CC1NCCS1 CS-0206098 [1,0,0,1,0,0|1,0,0]=3 83 B6R1.2 CN1CCOC1 CS-0247959 [1,0,0,1,0,0|2,0,0]=4 84 B6R1.2 NN1CCCC1 CS-W001610 [1,0,0,1,0,0|2,0,0]=4 85 B6R1.2 O=C1CCCS1 CS-0120136 [1,0,0,1,0,0|1,0,1]=4 86 B6R1.3 NNCC1CC1 CS-0053098 [1,0,0,1,0,0|2,0,0]=4 87 B6R1.3 OCC[C@H]1CO1 CS-0081472 [1,0,0,1,0,0|1,1,0]=4 88 B6R1.4 CC1CCC1=O CS-0611562 [1,0,0,1,0,0|0,1,1]=4 89 B6R1.4 N[C@@H]1CC[C@@H]1O CS-0184482 [1,0,0,1,0,0|1,1,0]=4 90 B6R1.6 FCC1CNC1 CS-0102314 [1,0,0,1,0,0|2,0,0]=4 91 B6R1.6 OC[C@@H]1CCO1 CS-0099311 [1,0,0,1,0,0|1,1,0]=4 92 B6R1.6 OC[C@H]1CCN1 CS-0053482 [1,0,0,1,0,0|1,1,0]=4 93 B8R1.2 CCC1CNCCO1 CS-0184012 [0,1,0,1,0,0|0,1,0]=3 94 B8R1.2 CC[C@@H]1CNCCN1 CS-M3408 [0,1,0,1,0,0|1,0,0]=3 95 B8R1.2 CC[C@H]1CNCCN1 CS-W023213 [0,1,0,1,0,0|1,0,0]=3 96 B8R1.2 CC[C@H]1COCCN1 CS-0146947 [0,1,0,1,0,0|1,0,0]=3 97 B8R1.2 FC[C@@H]1CNCCO1 CS-0566523 [0,1,0,1,0,0|1,1,0]=4 98 B8R1.2 FC[C@H]1CCCNC1 CS-0435451 [0,1,0,1,0,0|1,0,0]=3 99 B8R1.2 FC[C@H]1CNCCO1 CS-0566313 [0,1,0,1,0,0|1,1,0]=4 100 B8R1.2 N#C[C@H]1CCCCN1 CS-0054004 [0,1,0,1,0,0|1,0,1]=4 101 B8R1.2 NC[C@@H]1CCCNC1 CS-0169043 [0,1,0,1,0,0|1,0,0]=3 102 B8R1.2 NC[C@H]1CCCNC1 CS-0169042 [0,1,0,1,0,0|1,0,0]=3 103 B8R1.2 NC[C@H]1CCCNC1 CS-0173371 [0,1,0,1,0,0|1,0,0]=3 104 B8R1.2 OC[C@@H]1CNCCO1 CS-0020036 [0,1,0,1,0,0|1,1,0]=4 105 B8R1.5 CC1CCCCC1=O CS-W011265 [0,1,0,1,0,0|0,1,0]=3 106 B8R1.5 O[C@@H]1CCNC[C@H]1F CS-0368740 [0,1,0,1,0,0|1,1,0]=4 107 B8R1.5 O[C@@H]1CNCC[C@@H]1F CS-0502796 [0,1,0,1,0,0|1,1,0]=4 108 B8R1.8 C=CC[C@@H]1CCCN1 CS-0158619 [0,1,0,1,0,0|1,0,1]=4 109 B8R1.8 COC[C@H]1CCNC1 CS-0053272 [0,1,0,1,0,0|1,1,0]=4 110 B8R1.8 COC[C@H]1CCNC1 CS-0054797 [0,1,0,1,0,0|1,1,0]=4 111 B8R1.8 NNCC1CCCC1 CS-0049621 [0,1,0,1,0,0|1,0,0]=3 112 B8R1.8 OCCN1CCCC1 CS-W011235 [0,1,0,1,0,0|0,1,0]=3 113 B8R1.10 COCCC1CNC1 CS-0238278 [0,1,0,1,0,0|1,1,0]=4 114 B8R1.11 COC1CCCC1=O CS-0432948 [0,1,0,1,0,0|0,1,1]=4 115 B8R1.11 CO[C@@H]1CCC[C@H]1N CS-0183718 [0,1,0,1,0,0|1,0,0]=3 116 B8R1.11 CO[C@@H]1CCC[C@H]1N CS-0737895 [0,1,0,1,0,0|1,0,0]=3 117 B8R1.11 CO[C@@H]1CNC[C@@H]1F CS-0628353 [0,1,0,1,0,0|2,0,0]=4 118 B8R1.11 NCC1CCCC1O CS-0260689 [0,1,0,1,0,0|0,1,0]=3 119 B8R1.11 NCC1CCCC1O CS-0459964 [0,1,0,1,0,0|0,1,0]=3 120 B8R1.11 NC[C@H]1COC[C@@H]1O CS-0054588 [0,1,0,1,0,0|1,1,0]=4 121 B8R1.11 N[C@H]1COC[C@H]1CO CS-0613627 [0,1,0,1,0,0|1,1,0]=4 122 B8R1.13 COC[C@H]1CC[C@@H]1N CS-0433333 [0,1,0,1,0,0|1,0,0]=3 123 B8R1.13 COC[C@H]1CC[C@H]1N CS-0184248 [0,1,0,1,0,0|1,0,0]=3 124 B8R1.22 O=C1CCCOCC1 CS-0037287 [0,1,0,1,0,0|0,1,1]=4 125 B8R1.36 C#CCCNC1CC1 CS-0835641 [0,1,0,1,0,0|1,0,1]=4 126 B8R1.1 CCC1CCC(=O)O1 CS-W016608 [0,1,0,1,0,0|0,1,1]=4 127 B8R1.1 CN1CC[C@H](CO)C1 CS-0053041 [0,1,0,1,0,0|1,1,0]=4 128 B8R1.1 CO[C@H]1CC[C@H](N)C1 CS-0613346 [0,1,0,1,0,0|2,0,0]=4 129 B8R1.1 FC[C@@H]1C[C@H](F)CN1 CS-0039722 [0,1,0,1,0,0|2,0,0]=4 130 B8R1.3 CN1CCC(I)CC1 CS-0503495 [0,1,0,1,0,0|2,0,0]=4 131 B8R1.3 C[C@H]1CO[C@H](C)CN1 CS-0183890 [0,1,0,1,0,0|1,1,0]=4 132 B8R1.47 CCN1CC(CO)C1 CS-0484466 [0,1,0,1,0,0|1,1,0]=4 133 B8R1.47 CN[C@H]1C[C@@H](CO)C1 CS-0475754 [0,1,0,1,0,0|1,1,0]=4 134 B8R1.47 CN[C@H]1C[C@H](CO)C1 CS-0475755 [0,1,0,1,0,0|1,1,0]=4 135 B8R1.52 C#CC1(N)CCCC1 CS-0495139 [0,1,0,1,0,0|1,0,1]=4 136 B8R1.52 OCC1(F)CCNC1 CS-0183399 [0,1,0,1,0,0|1,1,0]=4 137 B8R1.4 CC1CC(O)CCO1 CS-0051835 [0,1,0,1,0,0|0,1,0]=3 138 B8R1.4 C[C@@H]1CCC[C@H](N)C1 CS-0309584 [0,1,0,1,0,0|1,0,0]=3 139 B8R1.4 C[C@@H]1C[C@H](O)CCO1 CS-0472514 [0,1,0,1,0,0|0,1,0]=3 140 B8R1.4 C[C@H]1CNC[C@H](C)N1 CS-0001867 [0,1,0,1,0,0|2,0,0]=4 141 B8R1.4 N[C@H]1CCC[C@@H](O)C1 CS-0042346 [0,1,0,1,0,0|0,1,0]=3 142 B8R1.6 CN1CC(CCN)C1 CS-0172752 [0,1,0,1,0,0|2,0,0]=4 143 B8R1.6 COCC1CC(N)C1 CS-0051675 [0,1,0,1,0,0|2,0,0]=4 144 B8R1.6 NC1CN(CCF)C1 CS-0506107 [0,1,0,1,0,0|2,0,0]=4 145 B8R1.7 CC(=O)[C@@H]1CCCO1 CS-0444349 [0,1,0,1,0,0|0,1,1]=4 146 B8R1.7 CC(N)C1CCOC1 CS-0486993 [0,1,0,1,0,0|2,0,0]=4 147 B8R1.7 CC(O)C1CCNC1 CS-0033515 [0,1,0,1,0,0|1,1,0]=4 148 B8R1.7 C[C@@H](N)C1CCCC1 CS-0135387 [0,1,0,1,0,0|1,0,0]=3 149 B8R1.7 FC(F)[C@H]1CCNC1 CS-0184109 [0,1,0,1,0,0|2,0,0]=4 150 B8R1.72 CC1(C)CNCCO1 CS-0052185 [0,1,0,1,0,0|1,1,0]=4 151 B8R1.37 N#CCC(O)C1CC1 CS-0245149 [0,1,0,1,0,0|1,0,1]=4 152 B8R1.37 NC(CCO)C1CC1 CS-0056047 [0,1,0,1,0,0|0,1,0]=3 153 B8R1.66 N#CCC1(N)CCC1 CS-0056997 [0,1,0,1,0,0|1,0,1]=4 154 B8R1.66 NC1(CCO)CCC1 CS-0044856 [0,1,0,1,0,0|0,1,0]=3 155 B8R1.66 OCCC1(F)COC1 CS-0057751 [0,1,0,1,0,0|1,1,0]=4 156 B8R2.25 C1CC2CC2CN1 CS-0059003 [0,0,0,2,0,0|1,0,0]=3 157 B8R2.42 C1CC2(C1)CCN2 CS-0131307 [0,0,0,2,0,0|1,0,0]=3 158 B8R2.19 NC1CCC12CC2 CS-0109007 [0,0,0,2,0,0|1,0,0]=3 159 B8R2.24 C1CC1NC2CC2 CS-W019025 [0,0,0,2,0,0|2,0,0]=4