0 B8R0.3 C=C(CBr)C(=O)OCC CS-W015793 [0,0,0,0,0,0|1,0,2]=3 1 B8R0.3 CCOC(=O)C(=O)CBr CS-W008597 [0,0,0,0,0,0|2,0,1]=3 2 B8R0.3 CCOC(=O)C(=O)CC CS-W005382 [0,0,0,0,0,0|1,0,1]=2 3 B8R0.3 CCOC(=O)C(Br)CBr CS-W012517 [0,0,0,0,0,0|2,0,0]=2 4 B8R0.3 CCOC(=O)[C@@H](N)CS CS-B1669 [0,0,0,0,0,0|2,0,0]=2 5 B8R0.3 [C@H](N)(CO)C(=O)OCC CS-W017712 [0,0,0,0,0,0|2,0,0]=2 6 B7R0.5 CCOC(=O)C(=O)[O-] CS-0046170 [1,0,0,0,0,0|2,0,1]=4 7 B7R0.5 CCOC(=O)C(N)=S CS-M2164 [1,0,0,0,0,0|2,0,1]=4 8 B7R0.5 CCOC(=O)[C@@H](C)N CS-W018066 [1,0,0,0,0,0|1,0,0]=2 9 B7R0.7 CC#CC(=O)OCC CS-W009547 [1,0,0,0,0,0|0,0,2]=3 10 B7R0.7 CCOC(=O)CCBr CS-W007449 [1,0,0,0,0,0|1,0,0]=2 11 B7R0.7 CCOC(=O)CNC CS-W020595 [1,0,0,0,0,0|1,0,0]=2 12 B7R0.10 C=C(CBr)C(=O)OC CS-W017298 [1,0,0,0,0,0|1,0,2]=4 13 B7R0.10 CC[C@@H](N)C(=O)OC CS-0059300 [1,0,0,0,0,0|1,0,0]=2 14 B7R0.10 COC(=O)C(=O)CBr CS-W008779 [1,0,0,0,0,0|2,0,1]=4 15 B7R0.10 COC(=O)C(Cl)CCl CS-W017982 [1,0,0,0,0,0|2,0,0]=3 16 B7R0.10 COC(=O)C(N)CO CS-W014338 [1,0,0,0,0,0|2,0,0]=3 17 B7R0.10 COC(=O)[C@@H](C)CO CS-W023098 [1,0,0,0,0,0|1,0,0]=2 18 B7R0.10 COC(=O)[C@H](N)CS CS-W020211 [1,0,0,0,0,0|2,0,0]=3 19 B7R0.10 [C@@H](N)(CO)C(=O)OC CS-W016249 [1,0,0,0,0,0|2,0,0]=3 20 B7R0.10 [C@H](C)(CC)[C@H](N)CO CS-W016591 [1,0,0,0,0,0|2,0,1]=4 21 B9R0.6 CCOC(=O)C(=O)C(C)Br CS-W006537 [0,1,0,0,0,0|1,0,1]=3 22 B9R0.6 CCOC(=O)C(C)C(C)=O CS-W004822 [0,1,0,0,0,0|0,0,1]=2 23 B9R0.6 CCOC(=O)[C@@H](N)[C@@H](C)O CS-W021073 [0,1,0,0,0,0|1,0,0]=2 24 B9R0.6 [C@@H](N)(C(=O)OCC)C(C)C CS-W008384 [0,1,0,0,0,0|1,0,0]=2 25 B9R0.23 CC(C)OC(=O)C(=O)CBr CS-M0667 [0,1,0,0,0,0|2,0,1]=4 26 B9R1.5 NC1CCCCNC1=O CS-M1433 [0,0,0,1,0,0|2,0,0]=3 27 B9R1.73 CCOC(=N)C1CCC1 CS-B1686 [0,0,0,1,0,0|1,0,0]=2 28 B9R1.73 CCOC(=O)C1CCC1 CS-D1706 [0,0,0,1,0,0|0,0,0]=1 29 B9R1.74 CCOC(=O)C1(Br)CC1 CS-W018973 [0,0,0,1,0,0|1,0,0]=2 30 B9R1.74 CCOC(=O)C1(N)CC1 CS-W008095 [0,0,0,1,0,0|1,0,0]=2 31 B9R0.34 C(C(=O)OCC)=C(\C)C=O CS-W008241 [0,0,0,0,0,1|1,0,2]=4 32 B9R0.34 CCOC(=O)CC(=O)CC CS-W019881 [0,0,0,0,0,1|1,0,1]=3 33 B9R0.34 CCOC(=O)CC(=O)CCl CS-D1440 [0,0,0,0,0,1|2,0,1]=4 34 B9R0.34 CCOC(=O)NC(=O)CCl CS-0093623 [0,0,0,0,0,1|2,0,1]=4 35 B6R0.1 CC#CC(=O)OC CS-0066219 [2,0,0,0,0,0|0,0,2]=4 36 B6R0.1 CCCC(Cl)CC CS-0102884 [2,0,0,0,0,0|1,0,1]=4 37 B6R0.1 CCOC(=O)C#N CS-0022374 [2,0,0,0,0,0|1,0,1]=4 38 B6R0.1 CCOC(=O)CO CS-W019892 [2,0,0,0,0,0|1,0,0]=3 39 B6R0.1 COC(=O)CCBr CS-W008728 [2,0,0,0,0,0|1,0,0]=3 40 B6R0.3 C=CC(C)C(=O)O CS-0006592 [2,0,0,0,0,0|0,0,2]=4 41 B6R0.3 CC(C)C(=O)NN CS-0053723 [2,0,0,0,0,0|2,0,0]=4 42 B6R0.3 CCC(N)C(=O)O CS-W011306 [2,0,0,0,0,0|1,0,0]=3 43 B6R0.3 CC[C@H](N)C(=O)O CS-0044026 [2,0,0,0,0,0|1,0,0]=3 44 B6R0.3 CC[C@H](N)C(N)=O CS-B0864 [2,0,0,0,0,0|2,0,0]=4 45 B6R0.3 CN(C)C(=O)CBr CS-W017882 [2,0,0,0,0,0|2,0,0]=4 46 B6R0.3 CN(C)C(=O)CN CS-0041045 [2,0,0,0,0,0|2,0,0]=4 47 B6R0.3 CN[C@H](C)C(=O)O CS-0094542 [2,0,0,0,0,0|1,0,0]=3 48 B6R0.3 COC(=O)C(C)N CS-W011040 [2,0,0,0,0,0|1,0,0]=3 49 B6R0.3 COC(=O)[C@H](C)N CS-W008772 [2,0,0,0,0,0|1,0,0]=3 50 B6R0.3 N[C@H](CCl)C(=O)O CS-0100201 [2,0,0,0,0,0|2,0,0]=4 51 B6R0.3 N[C@H](CS)C(=O)O CS-0046802 [2,0,0,0,0,0|2,0,0]=4 52 B6R0.3 N[C@H](CS)C(=O)O CS-W002074 [2,0,0,0,0,0|2,0,0]=4 53 B6R0.3 N[C@H](CS)C(=O)O CS-W019341 [2,0,0,0,0,0|2,0,0]=4 54 B6R0.3 [C@@H](C)(Cl)C(=O)OC CS-W011191 [2,0,0,0,0,0|1,0,0]=3 55 B6R0.3 [C@@H](C)(NC)C(=O)O CS-W016642 [2,0,0,0,0,0|1,0,0]=3 56 B6R0.3 [C@H](C)(N)C(=O)OC CS-W007986 [2,0,0,0,0,0|1,0,0]=3 57 B8R0.2 CON(C)C(=O)C(C)C CS-D0582 [1,1,0,0,0,0|2,0,0]=4 58 B8R0.14 CC(C)(C)C(=O)OCI CS-0066217 [1,1,0,0,0,0|1,0,0]=3 59 B8R0.23 CC(=O)C(=O)OC(C)C CS-M0668 [1,1,0,0,0,0|1,0,1]=4 60 B8R0.23 CC(C)OC(=O)[C@@H](C)N CS-M2998 [1,1,0,0,0,0|1,0,0]=3 61 B8R0.5 CCOC(=O)CC(C)N CS-0030781 [1,1,0,0,0,0|0,0,0]=2 62 B8R0.5 CCOC(=O)C[C@@H](C)O CS-D1461 [1,1,0,0,0,0|0,0,0]=2 63 B8R0.5 CCOC(=O)C[N+](=O)[O-] CS-0000037 [1,1,0,0,0,0|2,0,0]=4 64 B8R0.13 COC(=O)C(C)(C)C#N CS-0028771 [1,1,0,0,0,0|1,0,1]=4 65 B8R0.13 COC(=O)C(C)(C)CN CS-W018801 [1,1,0,0,0,0|1,0,0]=3 66 B8R0.13 COC(=O)C(C)(C)CO CS-W013414 [1,1,0,0,0,0|1,0,0]=3 67 B10R0.2 CCOC(=O)C[C@H](O)CC#N CS-W002591 [0,1,0,0,0,1|1,0,1]=4 68 B10R0.26 CCOC(=O)CC(=O)C(C)C CS-W016205 [0,1,0,0,0,1|1,0,1]=4 69 B10R0.36 CCOC(=O)C(C)(C)C(=O)O CS-M2955 [0,2,0,0,0,0|1,0,1]=4 70 B10R0.36 CCOC(=O)C(Cl)(Cl)C(C)=O CS-W010521 [0,2,0,0,0,0|1,0,1]=4 71 B10R0.19 CCOC(=O)[C@@H](N)CCCN CS-0101217 [0,2,0,0,0,0|1,0,0]=3 72 B10R0.32 [C@H](N)(CC(C)C)C(=O)OCC CS-W010608 [0,2,0,0,0,0|1,0,0]=3 73 B10R0.37 [C@@H](C)(NC)C(=O)OC(C)(C)C CS-W006595 [0,2,0,0,0,0|1,0,0]=3 74 B8R1.39 COC(=O)C1(N)CC1 CS-W008219 [1,0,0,1,0,0|1,0,0]=3 75 B10R1.135 CCOC(=O)C1CC1C#N CS-0049506 [0,0,0,1,0,1|1,0,1]=4 76 B10R1.137 CCOC(=O)CC1CCC1 CS-D0101 [0,0,0,1,0,1|0,0,0]=2 77 B10R1.61 CC(C)C1CNCCC1=O CS-D1334 [0,1,0,1,0,0|2,0,0]=4 78 B10R1.401 CCOC(=O)C1(Br)CCC1 CS-0034793 [0,1,0,1,0,0|0,0,0]=2 79 B10R1.401 CCOC(=O)C1(C)CCC1 CS-0045362 [0,1,0,1,0,0|0,0,0]=2 80 B10R1.191 CC1=C(C)C(C)C(C)C1=O CS-W011048 [0,1,0,1,0,0|1,0,1]=4 81 B10R1.11 CCOC(=O)[C@@H]1CSCN1 CS-0043107 [0,1,0,1,0,0|1,0,0]=3 82 B10R1.11 CCOC(=O)[C@H]1CCCN1 CS-0080165 [0,1,0,1,0,0|0,0,0]=2 83 B10R1.140 CCOC(=O)C1CC(O)C1 CS-0044007 [0,1,0,1,0,0|0,0,0]=2 84 B10R2.62 O=C1CN2CCC1CC2 CS-B0309 [0,0,0,2,0,0|2,0,0]=4