0 B22R2.145584 CC(C)(C)COC(=O)COc1cccc2c1CCC(=O)N2 34a_100000066681_200010402935 [0,0,0,0,0,0|2,0,2]=4 1 B22R2.145584 CC(C)(C)COC(=O)COc1cccc2c1CCC(=O)N2 7a_100000066681_200010402935 [0,0,0,0,0,0|2,0,2]=4 2 B21R2.107795 CC(=O)OCC(O)COc1cccc2c1CCC(=O)N2 34a_100000066681_200000139349 [1,0,0,0,0,0|2,0,1]=4 3 B21R2.107795 CC(=O)OCC(O)COc1cccc2c1CCC(=O)N2 7a_100000066681_200000139349 [1,0,0,0,0,0|2,0,1]=4 4 B21R2.108159 C[Si](C)(C)C#CCCOc1cccc2c1CCC(=O)N2 34a_100000066681_100010401983 [1,0,0,0,0,0|1,1,1]=4 5 B21R2.108159 C[Si](C)(C)C#CCCOc1cccc2c1CCC(=O)N2 7a_100000066681_100010401983 [1,0,0,0,0,0|1,1,1]=4 6 B21R2.108159 C[Si](C)(C)CCOCOc1cccc2c1CCC(=O)N2 34a_100000066681_100000032501 [1,0,0,0,0,0|2,1,0]=4 7 B23R2.5152835 CC(COc1cccc2c1CCC(=O)N2)C(=O)OC(C)(C)C 34a_100000066681_100050474178 [0,1,0,0,0,0|2,0,1]=4 8 B23R2.5152835 CC(COc1cccc2c1CCC(=O)N2)C(=O)OC(C)(C)C 7a_100000066681_100050474178 [0,1,0,0,0,0|2,0,1]=4 9 B21R1.135750 CCC(=O)Nc1cccc(c1)OCC(=O)CCC(C)(C)C 1458a_100011401373_100000755188 [0,0,1,0,0,0|1,0,2]=4 10 B21R1.135750 CCC(=O)Nc1cccc(c1)OCC(=O)NNC(C)(C)C 22a_100000725372_100011401373 [0,0,1,0,0,0|1,0,2]=4 11 B21R2.108171 CC(C)(C)NC(=O)COc1cccc2c1CCC(=O)N2 34a_100000066681_100000182746 [0,0,0,0,1,0|0,0,2]=3 12 B21R2.108171 CC(C)(C)NC(=O)COc1cccc2c1CCC(=O)N2 7a_100000066681_100000182746 [0,0,0,0,1,0|0,0,2]=3 13 B21R2.108171 CC(C)(C)NC(=O)CSc1cccc2c1CCC(=O)N2 62a_100000182746_100010232564 [0,0,0,0,1,0|0,1,2]=4 14 B21R2.108171 CC(C)(C)NC(=O)CSc1cccc2c1CCC(=O)N2 62a_100010232564_100000182746 [0,0,0,0,1,0|0,1,2]=4 15 B21R2.108171 CC(C)(C)OC(=O)COc1cccc2c1CCC(=O)N2 34a_100000066681_100000183872 [0,0,0,0,1,0|1,0,2]=4 16 B21R2.108171 CC(C)(C)OC(=O)COc1cccc2c1CCC(=O)N2 7a_100000066681_100000183872 [0,0,0,0,1,0|1,0,2]=4 17 B21R2.108171 C[N+](C)(C)CC(O)COc1cccc2c1CCC(=O)N2 34a_100000066681_100000032816 [0,0,0,0,1,0|1,0,0]=2 18 B21R2.108171 C[N+](C)(C)CC(O)COc1cccc2c1CCC(=O)N2 7a_100000066681_100000032816 [0,0,0,0,1,0|1,0,0]=2 19 B21R2.108171 C[N+](C)(C)CC(O)CSc1cccc2c1CCC(=O)C2 62a_100000032816_100010138409 [0,0,0,0,1,0|2,1,0]=4 20 B21R2.108171 C[N+](C)(C)CC(O)CSc1cccc2c1CCC(=O)C2 62a_100010138409_100000032816 [0,0,0,0,1,0|2,1,0]=4 21 B21R2.108171 C[N+](C)(C)CC(O)CSc1cccc2c1CCC(=O)N2 62a_100000032816_100010232564 [0,0,0,0,1,0|1,1,0]=3 22 B21R2.108171 C[N+](C)(C)CC(O)CSc1cccc2c1CCC(=O)N2 62a_100010232564_100000032816 [0,0,0,0,1,0|1,1,0]=3 23 B21R2.108171 C[N+](C)(C)CC(O)CSc1cccc2c1CCC(=O)O2 62a_100000032816_200015620928 [0,0,0,0,1,0|2,1,0]=4 24 B21R2.108171 C[N+](C)(C)CC(O)CSc1cccc2c1CCC(=O)O2 62a_200015620928_100000032816 [0,0,0,0,1,0|2,1,0]=4 25 B20R2.4802 CC(C)CCCCOc1cccc2c1CCC(=O)N2 34a_100000066681_100011216152 [2,0,0,0,0,0|1,0,0]=3 26 B20R2.4802 CC(C)CCCCOc1cccc2c1CCC(=O)N2 7a_100000066681_100011216152 [2,0,0,0,0,0|1,0,0]=3 27 B20R2.4802 CC(C)CCCCSc1cccc2c1CCC(=O)N2 62a_100010232564_100011216152 [2,0,0,0,0,0|1,1,0]=4 28 B20R2.4802 CC(C)CCCCSc1cccc2c1CCC(=O)N2 62a_100011216152_100010232564 [2,0,0,0,0,0|1,1,0]=4 29 B22R2.145582 CC(C)(C)NC(=O)CCOc1cccc2c1CCC(=O)N2 7a_100000066681_100011194433 [1,1,0,0,0,0|0,0,1]=3 30 B22R2.145582 CC(C)(C)NC(=O)CCSc1cccc2c1CCC(=O)N2 62a_100010232564_100011194433 [1,1,0,0,0,0|0,1,1]=4 31 B22R2.145582 CC(C)(C)NC(=O)CCSc1cccc2c1CCC(=O)N2 62a_100011194433_100010232564 [1,1,0,0,0,0|0,1,1]=4 32 B22R2.145582 CC(C)(C)OC(=O)CCOc1cccc2c1CCC(=O)N2 34a_100000066681_100009816755 [1,1,0,0,0,0|1,0,1]=4 33 B22R2.145582 CC(C)(C)OC(=O)CCOc1cccc2c1CCC(=O)N2 7a_100000066681_100009816755 [1,1,0,0,0,0|1,0,1]=4 34 B22R2.145580 CC(Oc1cccc2c1CCC(=O)N2)C(=O)NC(C)(C)C 7a_100000066681_100000230285 [0,1,0,0,1,0|0,0,2]=4 35 B22R2.5759655 CCC(C)(C)NC(=O)COc1cccc2c1CCC(=O)N2 34a_100000066681_100000230344 [0,1,0,0,1,0|0,0,2]=4 36 B22R2.5759655 CCC(C)(C)NC(=O)COc1cccc2c1CCC(=O)N2 7a_100000066681_100000230344 [0,1,0,0,1,0|0,0,2]=4 37 B22R3.258835 CC1(OCC(O1)CSc2cccc3c2CCC(=O)N3)C 62a_100000198056_100010232564 [1,0,0,1,0,0|1,1,0]=4 38 B22R3.258835 CC1(OCC(O1)CSc2cccc3c2CCC(=O)N3)C 62a_100010232564_100000198056 [1,0,0,1,0,0|1,1,0]=4 39 B22R3.258835 CC1(OC[C@@H](O1)COc2cccc3c2CCC(=O)N3)C 7a_100000066681_100015422573 [1,0,0,1,0,0|1,0,0]=3 40 B22R3.258835 CC1(OC[C@@H](O1)CSc2cccc3c2CCC(=O)N3)C 62a_100010232564_100015422573 [1,0,0,1,0,0|1,1,0]=4 41 B22R3.258835 CC1(OC[C@@H](O1)CSc2cccc3c2CCC(=O)N3)C 62a_100015422573_100010232564 [1,0,0,1,0,0|1,1,0]=4 42 B22R3.255996 CC1(CC(CCO1)Oc2cccc3c2CCC(=O)N3)C 34a_100000066681_100010191092 [1,0,0,1,0,0|1,0,0]=3 43 B22R3.255996 CC1(CC(CCO1)Oc2cccc3c2CCC(=O)N3)C 7a_100000066681_100010191092 [1,0,0,1,0,0|1,0,0]=3 44 B22R3.255996 CC1(CC(CCO1)Sc2cccc3c2CCC(=O)N3)C 62a_100010191092_100010232564 [1,0,0,1,0,0|1,1,0]=4 45 B22R3.255996 CC1(CC(CCO1)Sc2cccc3c2CCC(=O)N3)C 62a_100010232564_100010191092 [1,0,0,1,0,0|1,1,0]=4 46 B20R1.108328 CCC(=O)Nc1cccc(c1)NCC(O)C[N+](C)(C)C 34a_100000186510_100000032816 [0,0,1,0,1,0|2,0,0]=4 47 B20R1.108328 CCC(=O)Nc1cccc(c1)OCC(=O)NC(C)(C)C 11a_100000715429_100011401373 [0,0,1,0,1,0|0,0,2]=4 48 B20R1.108328 CCC(=O)Nc1cccc(c1)OCC(=O)NC(C)(C)C 240690a_100000715429_100011401373 [0,0,1,0,1,0|0,0,2]=4 49 B20R1.108328 CCC(=O)Nc1cccc(c1)OCC(=O)NC(C)(C)C 34a_100000158609_100000182746 [0,0,1,0,1,0|0,0,2]=4 50 B20R1.108328 CCC(=O)Nc1cccc(c1)OCC(=O)NC(C)(C)C 527a_100000715429_100011401373 [0,0,1,0,1,0|0,0,2]=4 51 B20R1.108328 CCC(=O)Nc1cccc(c1)OCC(=O)NC(C)(C)C 7a_100000158609_100000182746 [0,0,1,0,1,0|0,0,2]=4 52 B20R1.108328 CCC(=O)Nc1cccc(c1)OCC(O)C[N+](C)(C)C 34a_100000158609_100000032816 [0,0,1,0,1,0|1,0,0]=3 53 B20R1.108328 CCC(=O)Nc1cccc(c1)OCC(O)C[N+](C)(C)C 7a_100000158609_100000032816 [0,0,1,0,1,0|1,0,0]=3 54 B20R1.108328 COC(=O)Nc1cccc(c1)OCC(O)C[N+](C)(C)C 34a_100000741004_100000032816 [0,0,1,0,1,0|2,0,0]=4 55 B20R1.108328 COC(=O)Nc1cccc(c1)OCC(O)C[N+](C)(C)C 7a_100000741004_100000032816 [0,0,1,0,1,0|2,0,0]=4 56 B20R1.108328 C[N+](C)(C)CC(O)COc1cccc(c1)NC(=O)CCl 34a_100011236192_100000032816 [0,0,1,0,1,0|2,0,0]=4 57 B20R1.108328 C[N+](C)(C)CC(O)COc1cccc(c1)NC(=O)CCl 7a_100011236192_100000032816 [0,0,1,0,1,0|2,0,0]=4 58 B20R1.232759 CC(C)(C)NC(=O)COc1ccccc1CCC(=O)N 34a_100011200845_100000182746 [0,0,1,0,1,0|0,0,2]=4 59 B20R1.232759 CC(C)(C)NC(=O)COc1ccccc1CCC(=O)N 7a_100011200845_100000182746 [0,0,1,0,1,0|0,0,2]=4 60 B20R1.232759 C[N+](C)(C)CC(O)COc1ccccc1CCC(=O)N 34a_100011200845_100000032816 [0,0,1,0,1,0|1,0,0]=3 61 B20R1.232759 C[N+](C)(C)CC(O)COc1ccccc1CCC(=O)N 7a_100011200845_100000032816 [0,0,1,0,1,0|1,0,0]=3 62 B20R1.232759 C[N+](C)(C)CC(O)COc1ccccc1OCC(=O)N 7a_100000162348_100000032816 [0,0,1,0,1,0|2,0,0]=4 63 B20R1.232759 C[N+](C)(C)CC(O)CSc1ccccc1CCC(=O)N 62a_100000032816_100009814947 [0,0,1,0,1,0|1,1,0]=4 64 B20R1.232759 C[N+](C)(C)CC(O)CSc1ccccc1CCC(=O)N 62a_100009814947_100000032816 [0,0,1,0,1,0|1,1,0]=4 65 B20R1.3774924 CC(=O)Nc1cccc(c1C)NCC(O)C[N+](C)(C)C 34a_100000736503_100000032816 [0,0,1,0,1,0|2,0,0]=4 66 B20R1.3774924 CC(=O)Nc1cccc(c1C)NCC(O)C[N+](C)(C)C 7a_100000736503_100000032816 [0,0,1,0,1,0|2,0,0]=4 67 B20R2.4803 CC(C)CCC(C)Oc1cccc2c1CCC(=O)N2 34a_100000066681_100011261404 [1,0,0,0,1,0|2,0,0]=4 68 B20R2.75244 CC(C)NC(=O)COc1cccc2c1CCC(=O)N2 34a_100000066681_100000183996 [1,0,0,0,1,0|0,0,2]=4 69 B20R2.75244 CC(C)NC(=O)COc1cccc2c1CCC(=O)N2 7a_100000066681_100000183996 [1,0,0,0,1,0|0,0,2]=4 70 B20R2.75244 CC(COc1cccc2c1CCC(=O)N2)CN(C)C 7a_100000066681_100015348159 [1,0,0,0,1,0|2,0,0]=4 71 B20R2.75246 CC(C)(O)CCCOc1cccc2c1CCC(=O)N2 34a_100000066681_100009888830 [1,0,0,0,1,0|1,0,0]=3 72 B20R2.75246 CC(C)(O)CCCOc1cccc2c1CCC(=O)N2 7a_100000066681_100009888830 [1,0,0,0,1,0|1,0,0]=3 73 B20R2.75246 CC(C)(O)CCCSc1cccc2c1CCC(=O)N2 62a_100009888830_100010232564 [1,0,0,0,1,0|1,1,0]=4 74 B20R2.75246 CC(C)(O)CCCSc1cccc2c1CCC(=O)N2 62a_100010232564_100009888830 [1,0,0,0,1,0|1,1,0]=4 75 B20R2.75246 C[N+](C)(C)CCCOc1cccc2c1CCC(=O)N2 34a_100000066681_100016990835 [1,0,0,0,1,0|1,0,0]=3 76 B20R2.75246 C[N+](C)(C)CCCOc1cccc2c1CCC(=O)N2 7a_100000066681_100016990835 [1,0,0,0,1,0|1,0,0]=3 77 B20R2.75246 C[N+](C)(C)CCCSc1cccc2c1CCC(=O)N2 62a_100010232564_100016990835 [1,0,0,0,1,0|1,1,0]=4 78 B20R2.75246 C[N+](C)(C)CCCSc1cccc2c1CCC(=O)N2 62a_100016990835_100010232564 [1,0,0,0,1,0|1,1,0]=4 79 B20R2.75246 C[Si](C)(C)CCCOc1cccc2c1CCC(=O)N2 34a_100000066681_100011219597 [1,0,0,0,1,0|0,1,0]=3 80 B20R2.75246 C[Si](C)(C)CCCOc1cccc2c1CCC(=O)N2 7a_100000066681_100011219597 [1,0,0,0,1,0|0,1,0]=3 81 B20R2.75246 C[Si](C)(C)CCCSc1cccc2c1CCC(=O)N2 62a_100010232564_100011219597 [1,0,0,0,1,0|0,2,0]=4 82 B20R2.75246 C[Si](C)(C)CCCSc1cccc2c1CCC(=O)N2 62a_100011219597_100010232564 [1,0,0,0,1,0|0,2,0]=4 83 B20R2.75246 C[Si](C)(C)OCCOc1cccc2c1CCC(=O)N2 34a_100000066681_200000032530 [1,0,0,0,1,0|1,1,0]=4 84 B20R2.75246 C[Si](C)(C)OCCOc1cccc2c1CCC(=O)N2 7a_100000066681_200000032530 [1,0,0,0,1,0|1,1,0]=4 85 B20R2.2630 CC(C)(C)NC(=O)COc1cccc2c1CCC2=O 34a_100000240044_100000182746 [0,0,0,0,2,0|0,0,2]=4 86 B20R2.2630 CC(C)(C)NC(=O)COc1cccc2c1CCC2=O 7a_100000240044_100000182746 [0,0,0,0,2,0|0,0,2]=4 87 B20R2.2630 C[N+](C)(C)CC(O)COc1cccc2c1CCC2=O 34a_100000240044_100000032816 [0,0,0,0,2,0|1,0,0]=3 88 B20R2.2630 C[N+](C)(C)CC(O)COc1cccc2c1CCC2=O 7a_100000240044_100000032816 [0,0,0,0,2,0|1,0,0]=3 89 B20R2.2630 C[N+](C)(C)CC(O)COc1cccc2c1CNC2=O 34a_100000098541_100000032816 [0,0,0,0,2,0|2,0,0]=4 90 B20R2.2630 C[N+](C)(C)CC(O)CSc1cccc2c1CCC2=O 62a_100000032816_100000049675 [0,0,0,0,2,0|1,1,0]=4 91 B20R2.2630 C[N+](C)(C)CC(O)CSc1cccc2c1CCC2=O 62a_100000049675_100000032816 [0,0,0,0,2,0|1,1,0]=4 92 B20R2.75511 CC(C)(C)C(=O)COc1cccc2c1CCC(=O)N2 34a_100000066681_100000229897 [0,0,0,0,2,0|0,0,2]=4 93 B20R2.75511 CC(C)(C)C(=O)COc1cccc2c1CCC(=O)N2 7a_100000066681_100000210923 [0,0,0,0,2,0|0,0,2]=4 94 B20R2.152939 C[N+](C)(C)CC(O)CSc1cccc2c1CC(=O)N2 62a_100000032816_100009816812 [0,0,0,0,2,0|1,1,0]=4 95 B22R2.145554 CC(C)(O)CCCCCOc1cccc2c1CCC(=O)N2 34a_100000066681_100010402123 [1,0,0,0,0,1|2,0,0]=4 96 B22R2.145554 CC(C)(O)CCCCCOc1cccc2c1CCC(=O)N2 7a_100000066681_100010402123 [1,0,0,0,0,1|2,0,0]=4 97 B22R2.145554 C[N+](C)(C)CCCCCOc1cccc2c1CCC(=O)N2 34a_100000066681_100009813293 [1,0,0,0,0,1|2,0,0]=4 98 B22R2.145554 C[N+](C)(C)CCCCCOc1cccc2c1CCC(=O)N2 7a_100000066681_100009813293 [1,0,0,0,0,1|2,0,0]=4 99 B22R2.145554 C[Si](C)(C)C#CCCCOc1cccc2c1CCC(=O)N2 34a_100000066681_200000066390 [1,0,0,0,0,1|1,1,0]=4 100 B22R2.145554 C[Si](C)(C)C#CCCCOc1cccc2c1CCC(=O)N2 7a_100000066681_200000066390 [1,0,0,0,0,1|1,1,0]=4 101 B22R2.5852934 C[N+](C)(C)CC(O)CSc1cccc2c1CCCC(=O)N2 62a_100000032816_200000700058 [0,0,0,0,1,1|1,1,0]=4 102 B22R2.5852934 C[N+](C)(C)CC(O)CSc1cccc2c1CCCC(=O)N2 62a_200000700058_100000032816 [0,0,0,0,1,1|1,1,0]=4