0 B8R0.29 O=C(O)CCC(F)(F)F SPC-v732 [0,1,0,0,0,0|2,0,1]=4 1 B8R1.23 C=C1CC(C(=O)O)C1 SPC-g775 [0,0,0,1,0,0|2,0,0]=3 2 B8R1.23 CC(=O)C1CC(O)C1 SPC-v350 [0,0,0,1,0,0|2,0,1]=4 3 B8R1.23 CC1CC(C(=O)O)C1 SPC-m202 [0,0,0,1,0,0|2,0,1]=4 4 B8R1.23 CN1CC(C(=O)O)C1 SPC-a114 [0,0,0,1,0,0|3,0,0]=4 5 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 SPC-i346 [0,0,0,1,0,0|2,0,1]=4 6 B8R1.23 C[C@H]1C[C@H](C(=O)O)C1 SPC-i384 [0,0,0,1,0,0|2,0,1]=4 7 B8R1.23 NC1CC(C(=O)O)C1 SPC-q735 [0,0,0,1,0,0|2,0,1]=4 8 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 SPC-h937 [0,0,0,1,0,0|2,0,1]=4 9 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 SPC-i508 [0,0,0,1,0,0|2,0,1]=4 10 B8R1.23 O=C(O)C1CC(Cl)C1 SPC-h856 [0,0,0,1,0,0|2,0,1]=4 11 B8R1.23 O=C(O)C1CC(F)C1 SPC-a125 [0,0,0,1,0,0|2,0,1]=4 12 B8R1.23 O=C(O)C1CC(O)C1 SPC-p384 [0,0,0,1,0,0|1,0,1]=3 13 B8R1.23 O=C(O)[C@H]1C[C@@H](F)C1 SPC-q739 [0,0,0,1,0,0|2,0,1]=4 14 B8R1.23 O=C(O)[C@H]1C[C@@H](O)C1 SPC-h918 [0,0,0,1,0,0|1,0,1]=3 15 B8R1.23 O=C(O)[C@H]1C[C@H](Cl)C1 SPC-h952 [0,0,0,1,0,0|2,0,1]=4 16 B8R1.23 O=C(O)[C@H]1C[C@H](F)C1 SPC-q738 [0,0,0,1,0,0|2,0,1]=4 17 B8R1.23 O=C(O)[C@H]1C[C@H](O)C1 SPC-i654 [0,0,0,1,0,0|1,0,1]=3 18 B8R1.23 O=C1CC(C(=O)O)C1 SPC-g640 [0,0,0,1,0,0|1,0,0]=2 19 B8R1.23 O=C1C[C@@H](C(=O)O)N1 SPC-i679 [0,0,0,1,0,0|1,0,0]=2 20 B8R1.23 O=C1C[C@@H](C(=O)O)O1 SPC-u889 [0,0,0,1,0,0|0,0,0]=1 21 B8R1.23 O=C1C[C@H](C(=O)O)N1 SPC-i186 [0,0,0,1,0,0|1,0,0]=2 22 B8R1.77 O=C(O)[C@@H]1CC1(F)F SPC-n672 [0,0,0,1,0,0|2,0,1]=4 23 B8R1.77 O=C(O)[C@H]1CC1(F)F SPC-j902 [0,0,0,1,0,0|2,0,1]=4 24 B8R1.77 O=C(O)[C@H]1CC1(F)F SPC-q542 [0,0,0,1,0,0|2,0,1]=4 25 B7R1.2 O=C1CCC(=O)C1 SPC-h715 [1,0,0,1,0,0|1,0,0]=3 26 B7R1.2 O=C1CC[C@H](O)C1 SPC-q537 [1,0,0,1,0,0|1,0,1]=4 27 B7R1.2 O=C1CNC(=O)C1 SPC-n497 [1,0,0,1,0,0|2,0,0]=4 28 B7R1.3 O=C1CCCOC1 SPC-g865 [1,0,0,1,0,0|1,0,1]=4 29 B7R1.10 O=C1CC(CO)C1 SPC-h515 [1,0,0,1,0,0|1,0,1]=4 30 B7R1.10 O=C1C[C@H](CO)N1 SPC-t669 [1,0,0,1,0,0|1,0,1]=4 31 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O SPC-v344 [1,0,0,1,0,0|1,0,1]=4 32 B7R1.12 C[C@@H]1C[C@H]1C(=O)O SPC-t366 [1,0,0,1,0,0|1,0,1]=4 33 B7R1.12 C[C@H]1C[C@H]1C(=O)O SPC-t640 [1,0,0,1,0,0|1,0,1]=4 34 B7R1.12 C[C@H]1C[C@H]1C(=O)O SPC-v485 [1,0,0,1,0,0|1,0,1]=4 35 B7R1.12 O=C(O)C1CC1F SPC-s871 [1,0,0,1,0,0|1,0,1]=4 36 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F SPC-s015 [1,0,0,1,0,0|1,0,1]=4 37 B7R1.12 O=C(O)[C@@H]1C[C@H]1F SPC-s012 [1,0,0,1,0,0|1,0,1]=4 38 B7R1.12 O=C(O)[C@@H]1C[C@H]1F SPC-t365 [1,0,0,1,0,0|1,0,1]=4 39 B7R1.12 O=C(O)[C@H]1C[C@@H]1F SPC-s008 [1,0,0,1,0,0|1,0,1]=4 40 B7R1.12 O=C(O)[C@H]1C[C@H]1F SPC-s005 [1,0,0,1,0,0|1,0,1]=4 41 B7R1.12 O=C(O)[C@H]1C[C@H]1F SPC-t140 [1,0,0,1,0,0|1,0,1]=4 42 B7R1.18 O=C(O)C1CCC1 SPC-a107 [1,0,0,1,0,0|1,0,1]=4 43 B7R1.18 O=C(O)C1CNC1 SPC-g671 [1,0,0,1,0,0|2,0,0]=4 44 B7R1.18 O=C(O)C1COC1 SPC-a017 [1,0,0,1,0,0|2,0,0]=4 45 B7R1.18 O=C(O)C1CSC1 SPC-a106 [1,0,0,1,0,0|2,0,0]=4 46 B7R1.18 O=C(O)[C@@H]1CCN1 SPC-g935 [1,0,0,1,0,0|1,0,1]=4 47 B7R1.18 O=C(O)[C@@H]1CCN1 SPC-h064 [1,0,0,1,0,0|1,0,1]=4 48 B7R1.18 O=C(O)[C@@H]1CCO1 SPC-a304 [1,0,0,1,0,0|0,0,1]=3 49 B7R1.18 O=C(O)[C@@H]1CCO1 SPC-u910 [1,0,0,1,0,0|0,0,1]=3 50 B7R1.18 O=C(O)[C@H]1CCN1 SPC-h200 [1,0,0,1,0,0|1,0,1]=4 51 B7R1.18 O=C(O)[C@H]1CCO1 SPC-u911 [1,0,0,1,0,0|0,0,1]=3 52 B7R1.20 O=C(O)CC1CC1 SPC-g479 [1,0,0,1,0,0|1,0,1]=4 53 B7R1.20 O=C(O)C[C@H]1CO1 SPC-v405 [1,0,0,1,0,0|0,0,1]=3 54 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 SPC-g127 [0,0,0,1,0,1|1,0,1]=4 55 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 SPC-m778 [0,0,0,1,0,1|1,0,1]=4 56 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 SPC-t597 [0,0,0,1,0,1|1,0,1]=4 57 B9R1.35 O=C1CC[C@@H](C(=O)O)C1 SPC-h594 [0,0,0,1,0,1|1,0,0]=3 58 B9R1.35 O=C1CC[C@@H](C(=O)O)O1 SPC-g806 [0,0,0,1,0,1|0,0,0]=2 59 B9R1.35 O=C1CC[C@@H](C(=O)O)S1 SPC-p725 [0,0,0,1,0,1|0,1,0]=3 60 B9R1.35 O=C1CC[C@H](C(=O)O)C1 SPC-h678 [0,0,0,1,0,1|1,0,0]=3 61 B9R1.35 O=C1CC[C@H](C(=O)O)C1 SPC-k770 [0,0,0,1,0,1|1,0,0]=3 62 B9R1.35 O=C1CN[C@H](C(=O)O)C1 SPC-k492 [0,0,0,1,0,1|1,0,0]=3 63 B9R1.35 O=C1C[C@H](C(=O)O)CN1 SPC-j969 [0,0,0,1,0,1|1,0,0]=3 64 B9R1.53 CC(=O)OC1CC(=O)C1 SPC-h444 [0,0,0,1,0,1|2,0,0]=4 65 B9R1.53 O=C(O)CC1CC(=O)C1 SPC-p081 [0,0,0,1,0,1|1,0,0]=3 66 B9R1.161 NC(=O)C1CC1C(=O)O SPC-k404 [0,0,0,1,0,1|1,0,0]=3 67 B9R1.82 C=C1CC(C(=O)OC)C1 SPC-h791 [0,1,0,1,0,0|2,0,0]=4 68 B9R1.82 COC(=O)C1CC(=O)C1 SPC-g763 [0,1,0,1,0,0|1,0,0]=3 69 B9R1.82 COC(=O)C1CC(O)C1 SPC-h741 [0,1,0,1,0,0|1,0,1]=4 70 B9R1.82 COC(=O)[C@H]1C[C@@H](O)C1 SPC-h432 [0,1,0,1,0,0|1,0,1]=4 71 B9R1.82 COC(=O)[C@H]1C[C@H](O)C1 SPC-h525 [0,1,0,1,0,0|1,0,1]=4 72 B9R1.95 COC1CC(C(=O)O)C1 SPC-i683 [0,1,0,1,0,0|1,0,1]=4 73 B9R1.95 CO[C@H]1C[C@@H](C(=O)O)C1 SPC-i655 [0,1,0,1,0,0|1,0,1]=4 74 B9R1.95 CO[C@H]1C[C@H](C(=O)O)C1 SPC-i033 [0,1,0,1,0,0|1,0,1]=4 75 B9R1.152 C=C1CC(C)(C(=O)O)C1 SPC-m876 [0,1,0,1,0,0|2,0,0]=4 76 B9R1.152 CC1(C(=O)O)CC(=O)C1 SPC-i556 [0,1,0,1,0,0|1,0,0]=3 77 B9R1.152 NC1(C(=O)O)CC(O)C1 SPC-s756 [0,1,0,1,0,0|1,0,1]=4 78 B9R1.164 CC1(O)CC(C(=O)O)C1 SPC-h988 [0,1,0,1,0,0|1,0,1]=4