0 B8R0.23 C=C(C)CN(C)C(=O)C 11a_100000225649_100015343762 [0,0,0,0,0,0|3,0,0]=3 1 B8R0.23 C=C(C)CN(C)C(=O)C 1626a_100000225649_100015343762 [0,0,0,0,0,0|3,0,0]=3 2 B8R0.23 C=C(C)CN(C)C(=O)C 527a_100000225649_100103153847 [0,0,0,0,0,0|3,0,0]=3 3 B8R0.23 CC(=O)C(C)CC(C)C 1458a_100000070787_100000731052 [0,0,0,0,0,0|2,0,1]=3 4 B8R0.23 CC(=O)C(C)CN(C)C 1458a_200015186601_200000210301 [0,0,0,0,0,0|3,0,0]=3 5 B8R0.23 CC(=O)C(C)NC(C)C 2230a_100138425928_100009814033 [0,0,0,0,0,0|2,0,1]=3 6 B8R0.23 CC(=O)C(C)OC(C)C 34a_100000212229_100000210206 [0,0,0,0,0,0|1,0,1]=2 7 B8R0.23 CC(=O)C(C)SC(C)C 62a_100000210206_100009814033 [0,0,0,0,0,0|1,1,1]=3 8 B8R0.23 CC(=O)C(C)SC(C)C 62a_100009814033_100000210206 [0,0,0,0,0,0|1,1,1]=3 9 B8R0.23 CC(=O)CC(=O)C(=O)C 1458a_100000070787_100011261029 [0,0,0,0,0,0|2,0,1]=3 10 B8R0.23 CC(=O)CC(C)N(C)C 1458a_100011311895_200000210301 [0,0,0,0,0,0|3,0,0]=3 11 B8R0.23 CC(=O)CN(C)C(=O)C 1458a_100000194957_200000210301 [0,0,0,0,0,0|2,0,0]=2 12 B8R0.23 CC(=O)CN(C)C(=O)N 1458a_100000218718_200000210301 [0,0,0,0,0,0|3,0,0]=3 13 B8R0.23 CC(=O)CN(C)C(C)C 1458a_100000743827_200000210301 [0,0,0,0,0,0|3,0,1]=4 14 B8R0.23 CC(=O)N(C)CC(=O)N 11a_100000739694_100015343762 [0,0,0,0,0,0|3,0,0]=3 15 B8R0.23 CC(=O)N(C)CC(=O)N 527a_100000739694_100103153847 [0,0,0,0,0,0|3,0,0]=3 16 B8R0.23 CC(=O)N(C)CC(=O)[13CH3] 1458a_100000194957_200025704644 [0,0,0,0,0,0|2,0,0]=2 17 B8R0.23 CC(=O)N(C)CC(C)C 11a_100000747067_100015343762 [0,0,0,0,0,0|3,0,1]=4 18 B8R0.23 CC(=O)N(C)CC(C)C 1626a_100000747067_100015343762 [0,0,0,0,0,0|3,0,1]=4 19 B8R0.23 CC(=O)N(C)CC(C)C 240690a_100000747067_100015343762 [0,0,0,0,0,0|3,0,1]=4 20 B8R0.23 CC(=O)N(C)CC(C)C 527a_100000747067_100103153847 [0,0,0,0,0,0|3,0,1]=4 21 B8R0.23 CC(=O)N(C)CC(C)O 240690a_100000227577_100015343762 [0,0,0,0,0,0|2,0,2]=4 22 B8R0.23 CC(=O)N(C)CC(C)O 527a_100000227577_100103153847 [0,0,0,0,0,0|2,0,2]=4 23 B8R0.23 CC(=O)NC(C)C(C)C 11a_100000211541_100015343762 [0,0,0,0,0,0|2,0,1]=3 24 B8R0.23 CC(=O)NC(C)C(C)C 1626a_100000211541_100015343762 [0,0,0,0,0,0|2,0,1]=3 25 B8R0.23 CC(=O)NC(C)C(C)C 240690a_100000211541_100015343762 [0,0,0,0,0,0|2,0,1]=3 26 B8R0.23 CC(=O)NC(C)C(C)C 527a_100000211541_100103153847 [0,0,0,0,0,0|2,0,1]=3 27 B8R0.23 CC(=O)N[C@H](C)C(=O)C 1458a_100011504603_200000210301 [0,0,0,0,0,0|1,0,0]=1 28 B8R0.23 CC(=O)N[C@H](C)C(=O)N 11a_100000119354_100015343762 [0,0,0,0,0,0|2,0,0]=2 29 B8R0.23 CC(=O)N[C@H](C)C(=O)N 240690a_100000119354_100015343762 [0,0,0,0,0,0|2,0,0]=2 30 B8R0.23 CC(=O)N[C@H](C)C(=O)N 527a_100000119354_100103153847 [0,0,0,0,0,0|2,0,0]=2 31 B8R0.23 CC(=O)N[C@H](C)C(=O)[13CH3] 1458a_100011504603_200025704644 [0,0,0,0,0,0|1,0,0]=1 32 B8R0.23 CC(=O)OC(C)C(=O)C 1458a_100000070787_100009818208 [0,0,0,0,0,0|0,0,0]=0 33 B8R0.23 CC(=O)OC(C)N(C)C 269982a_100102631434_100009818208 [0,0,0,0,0,0|2,0,0]=2 34 B8R0.23 CC(=O)O[C@@H](C)C(=O)C 1458a_100009816467_200000210301 [0,0,0,0,0,0|0,0,0]=0 35 B8R0.23 CC(=O)O[C@@H](C)C(=O)[13CH3] 1458a_100009816467_200025704644 [0,0,0,0,0,0|0,0,0]=0 36 B8R0.23 CC(=O)[C@@H](O)CC(C)C 1458a_100012027011_200000210301 [0,0,0,0,0,0|3,0,1]=4 37 B8R0.23 CC(C)C[C@H](O)C(=O)[13CH3] 1458a_100012027011_200025704644 [0,0,0,0,0,0|3,0,1]=4 38 B8R0.23 CC(C)N(C)CC(=O)[13CH3] 1458a_100000743827_200025704644 [0,0,0,0,0,0|3,0,1]=4 39 B8R0.23 CC(C)NC(C)C(=O)N 2230a_100138425928_100000702099 [0,0,0,0,0,0|3,0,1]=4 40 B8R0.23 CC(C)NC(C)C(=O)N 34a_100138425928_100000702099 [0,0,0,0,0,0|3,0,1]=4 41 B8R0.23 CC(C)N[C@@H](C)C(=O)O 269956a_100000743915_100000210206 [0,0,0,0,0,0|3,0,1]=4 42 B8R0.23 CC(C)N[C@H](C)C(=O)N 2230a_100000119354_100000210206 [0,0,0,0,0,0|3,0,1]=4 43 B8R0.23 CC(C)N[C@H](C)C(=O)N 34a_100000119354_100000210206 [0,0,0,0,0,0|3,0,1]=4 44 B8R0.23 CC(C)OC(C)C(=O)N 34a_100000212225_100000702099 [0,0,0,0,0,0|2,0,1]=3 45 B8R0.23 CC(C)OC(C)C(C)C 7a_100000748068_100000210206 [0,0,0,0,0,0|2,0,2]=4 46 B8R0.23 CC(C)OC(F)C(=O)N 34a_100000212225_100009813875 [0,0,0,0,0,0|3,0,1]=4 47 B8R0.23 CC(C)OC(F)C(=O)[O-] 34a_100000212225_100020610796 [0,0,0,0,0,0|3,0,1]=4 48 B8R0.23 CC(C)O[C@@H](C)C(=O)[O-] 7a_217856618621_100000210206 [0,0,0,0,0,0|2,0,1]=3 49 B8R0.23 CC(C)O[C@H](C)C(=O)N 34a_100000731257_100000210206 [0,0,0,0,0,0|2,0,1]=3 50 B8R0.23 CC(C)O[C@H](C)C(=O)N 7a_100000731257_100000210206 [0,0,0,0,0,0|2,0,1]=3 51 B8R0.23 CC(C)SC(C)C(=O)N 62a_100000210206_100000702099 [0,0,0,0,0,0|2,1,1]=4 52 B8R0.23 CC(C)SC(C)C(=O)N 62a_100000702099_100000210206 [0,0,0,0,0,0|2,1,1]=4 53 B8R0.23 CC(CC(=O)[13CH3])N(C)C 1458a_100011311895_200025704644 [0,0,0,0,0,0|3,0,0]=3 54 B8R0.23 CC(CN(C)C)C(=O)[13CH3] 1458a_200015186601_200025704644 [0,0,0,0,0,0|3,0,0]=3 55 B8R0.23 CN(CC(=O)[13CH3])C(=O)N 1458a_100000218718_200025704644 [0,0,0,0,0,0|3,0,0]=3 56 B7R0.2 C#CC(C)NC(=O)C 11a_100000707721_100015343762 [1,0,0,0,0,0|1,0,2]=4 57 B7R0.2 C#CC(C)NC(=O)C 1626a_100000707721_100015343762 [1,0,0,0,0,0|1,0,2]=4 58 B7R0.2 C#CC(C)NC(=O)C 240690a_100000707721_100015343762 [1,0,0,0,0,0|1,0,2]=4 59 B7R0.2 C#CC(C)NC(=O)C 527a_100000707721_100103153847 [1,0,0,0,0,0|1,0,2]=4 60 B7R0.2 C=CC(C)CC(=O)C 1458a_100011934298_200000210301 [1,0,0,0,0,0|1,0,1]=3 61 B7R0.2 C=CC(C)CC(=O)[13CH3] 1458a_100011934298_200025704644 [1,0,0,0,0,0|1,0,1]=3 62 B7R0.2 C=CC(C)OC(C)C 34a_100000695699_100000210206 [1,0,0,0,0,0|1,0,2]=4 63 B7R0.2 CC(=CC(C)O[13CH3])C 34a_100000717055_200025704644 [1,0,0,0,0,0|3,0,0]=4 64 B7R0.2 CC(=O)C[C@@H](C)CO 1458a_100000070787_100000059175 [1,0,0,0,0,0|1,0,2]=4 65 B7R0.2 CC(=O)NC(C)C#N 11a_100000737613_100015343762 [1,0,0,0,0,0|2,0,1]=4 66 B7R0.2 CC(=O)NC(C)C#N 1626a_100000737613_100015343762 [1,0,0,0,0,0|2,0,1]=4 67 B7R0.2 CC(=O)NC(C)C#N 527a_100000737613_100103153847 [1,0,0,0,0,0|2,0,1]=4 68 B7R0.2 CC(=O)N[C@H](C)CF 11a_100102880703_100015343762 [1,0,0,0,0,0|2,0,1]=4 69 B7R0.2 CC(=O)N[C@H](C)CF 1626a_100102880703_100015343762 [1,0,0,0,0,0|2,0,1]=4 70 B7R0.2 CC(=O)N[C@H](C)CF 240690a_100102880703_100015343762 [1,0,0,0,0,0|2,0,1]=4 71 B7R0.2 CC(=O)N[C@H](C)CF 527a_100102880703_100103153847 [1,0,0,0,0,0|2,0,1]=4 72 B7R0.2 CC(=O)N[C@H](C)CO 240690a_100000737577_100015343762 [1,0,0,0,0,0|1,0,2]=4 73 B7R0.2 CC(=O)N[C@H](C)CO 527a_100000737577_100103153847 [1,0,0,0,0,0|1,0,2]=4 74 B7R0.2 CC(=O)OC(C)S[13CH3] 62a_100009818208_200025704644 [1,0,0,0,0,0|1,0,0]=2 75 B7R0.2 CC(=O)OC(C)S[13CH3] 62a_200025704644_100009818208 [1,0,0,0,0,0|1,0,0]=2 76 B7R0.2 CCC(=CC(=O)C)C 1458a_100020758463_200000210301 [1,0,0,0,0,0|1,0,2]=4 77 B7R0.2 CCC(=CC(=O)[13CH3])C 1458a_100020758463_200025704644 [1,0,0,0,0,0|1,0,2]=4 78 B7R0.2 CCC(C)CC(=O)C 1458a_100000070787_100000748023 [1,0,0,0,0,0|1,0,1]=3 79 B7R0.2 CCC(C)CC(=O)C 1458a_100000708755_200000210301 [1,0,0,0,0,0|1,0,1]=3 80 B7R0.2 CCC(C)CC(=O)[13CH3] 1458a_100000708755_200025704644 [1,0,0,0,0,0|1,0,1]=3 81 B7R0.2 CCC(C)NC(=O)C 11a_100000209981_100015343762 [1,0,0,0,0,0|1,0,1]=3 82 B7R0.2 CCC(C)NC(=O)C 1626a_100000209981_100015343762 [1,0,0,0,0,0|1,0,1]=3 83 B7R0.2 CCC(C)NC(=O)C 240690a_100000209981_100015343762 [1,0,0,0,0,0|1,0,1]=3 84 B7R0.2 CCC(C)NC(=O)C 527a_100000209981_100103153847 [1,0,0,0,0,0|1,0,1]=3 85 B7R0.2 CCC(C)OC(C)C 34a_100000212225_100011215416 [1,0,0,0,0,0|1,0,2]=4 86 B7R0.2 CCC(C)OC(C)C 7a_100000210228_100000210206 [1,0,0,0,0,0|1,0,2]=4 87 B7R0.2 CCC(O)CC(=O)C 1458a_100000070787_100011218378 [1,0,0,0,0,0|2,0,1]=4 88 B7R0.2 CCC(O)CC(=O)C 1458a_100011667805_200000210301 [1,0,0,0,0,0|2,0,1]=4 89 B7R0.2 CCC(O)CC(=O)[13CH3] 1458a_100011667805_200025704644 [1,0,0,0,0,0|2,0,1]=4 90 B7R0.2 CCN(C)CC(=O)C 1458a_100116209913_200000210301 [1,0,0,0,0,0|2,0,1]=4 91 B7R0.2 CCN(C)CC(=O)[13CH3] 1458a_100116209913_200025704644 [1,0,0,0,0,0|2,0,1]=4 92 B7R0.2 CC[C@H](C)CC(=O)C 1458a_100000070787_100009816398 [1,0,0,0,0,0|1,0,1]=3 93 B7R0.2 COC(C)C=C(C)C 34a_100000717055_200000210301 [1,0,0,0,0,0|3,0,0]=4 94 B7R0.2 CSC(C)OC(=O)C 62a_100009818208_200000210301 [1,0,0,0,0,0|1,0,0]=2 95 B7R0.2 CSC(C)OC(=O)C 62a_200000210301_100009818208 [1,0,0,0,0,0|1,0,0]=2 96 B7R0.5 C=C(C)C(C)NCC 269862a_100015525214_100011216138 [1,0,0,0,0,0|2,0,1]=4 97 B7R0.5 C=CCC(C)C(=O)C 1458a_100011216819_200000210301 [1,0,0,0,0,0|1,0,1]=3 98 B7R0.5 C=CCC(C)C(=O)[13CH3] 1458a_100011216819_200025704644 [1,0,0,0,0,0|1,0,1]=3 99 B7R0.5 C=CCN(C)C(=O)C 11a_100000225617_100015343762 [1,0,0,0,0,0|2,0,1]=4 100 B7R0.5 C=CCN(C)C(=O)C 1626a_100000225617_100015343762 [1,0,0,0,0,0|2,0,1]=4 101 B7R0.5 C=CCN(C)C(=O)C 240690a_100000225617_100015343762 [1,0,0,0,0,0|2,0,1]=4 102 B7R0.5 C=CCN(C)C(=O)C 527a_100000225617_100103153847 [1,0,0,0,0,0|2,0,1]=4 103 B7R0.5 CC(=O)C(C)CC#N 1458a_100000070787_100009813641 [1,0,0,0,0,0|2,0,1]=4 104 B7R0.5 CC(=O)C(C)CCO 1458a_100000070787_100009893172 [1,0,0,0,0,0|1,0,2]=4 105 B7R0.5 CC(=O)C(C)CO[13CH3] 34a_100000032740_200025704644 [1,0,0,0,0,0|2,0,0]=3 106 B7R0.5 CC(=O)C(C)CO[13CH3] 7a_100000032740_200025704644 [1,0,0,0,0,0|2,0,0]=3 107 B7R0.5 CC(=O)C(C)OCF 34a_100000212229_100015361967 [1,0,0,0,0,0|1,0,1]=3 108 B7R0.5 CC(=O)C(C)SCF 62a_100009814033_100015361967 [1,0,0,0,0,0|1,1,1]=4 109 B7R0.5 CC(=O)C(C)SCF 62a_100015361967_100009814033 [1,0,0,0,0,0|1,1,1]=4 110 B7R0.5 CC(CN[13CH3])C(=O)O 269956a_100000749485_200025704644 [1,0,0,0,0,0|3,0,0]=4 111 B7R0.5 CC/C=C(\C)/C(=O)C 1458a_100016988807_200000210301 [1,0,0,0,0,0|1,0,2]=4 112 B7R0.5 CC/C=C(\C)/C(=O)[13CH3] 1458a_100016988807_200025704644 [1,0,0,0,0,0|1,0,2]=4 113 B7R0.5 CCCC(C)C(=O)C 1458a_100000070787_100000766640 [1,0,0,0,0,0|1,0,1]=3 114 B7R0.5 CCCC(C)C(=O)C 1458a_100000210906_200000210301 [1,0,0,0,0,0|1,0,1]=3 115 B7R0.5 CCCC(C)C(=O)[13CH3] 1458a_100000210906_200025704644 [1,0,0,0,0,0|1,0,1]=3 116 B7R0.5 CCCN(C)C(=O)C 11a_100000747261_100015343762 [1,0,0,0,0,0|2,0,1]=4 117 B7R0.5 CCCN(C)C(=O)C 1626a_100000747261_100015343762 [1,0,0,0,0,0|2,0,1]=4 118 B7R0.5 CCCN(C)C(=O)C 240690a_100000747261_100015343762 [1,0,0,0,0,0|2,0,1]=4 119 B7R0.5 CCCN(C)C(=O)C 527a_100000747261_100103153847 [1,0,0,0,0,0|2,0,1]=4 120 B7R0.5 CCC[C@H](O)C(=O)C 1458a_100009822183_200000210301 [1,0,0,0,0,0|2,0,1]=4 121 B7R0.5 CCC[C@H](O)C(=O)[13CH3] 1458a_100009822183_200025704644 [1,0,0,0,0,0|2,0,1]=4 122 B7R0.5 CCNC(C)C(=O)C 2230a_100015525214_100009814033 [1,0,0,0,0,0|1,0,1]=3 123 B7R0.5 CCNC(C)C(=O)N 2230a_100015525214_100000702099 [1,0,0,0,0,0|2,0,1]=4 124 B7R0.5 CCN[C@@H](C)C(=O)O 269956a_100000743915_100000210202 [1,0,0,0,0,0|2,0,1]=4 125 B7R0.5 CCN[C@H](C)C(=O)N 2230a_100000119354_100000210202 [1,0,0,0,0,0|2,0,1]=4 126 B7R0.5 CCN[C@H](C)C(=O)N 34a_100000119354_100000210202 [1,0,0,0,0,0|2,0,1]=4 127 B7R0.5 CCOC(C)C(=O)C 1458a_100000739345_200000210301 [1,0,0,0,0,0|0,0,1]=2 128 B7R0.5 CCOC(C)C(=O)C 34a_100000212229_100000210202 [1,0,0,0,0,0|0,0,1]=2 129 B7R0.5 CCOC(C)C(=O)N 34a_100121572206_100000702099 [1,0,0,0,0,0|1,0,1]=3 130 B7R0.5 CCOC(C)C(=O)[13CH3] 1458a_100000739345_200025704644 [1,0,0,0,0,0|0,0,1]=2 131 B7R0.5 CCOC(C)C(C)C 7a_100000748068_100000210202 [1,0,0,0,0,0|1,0,2]=4 132 B7R0.5 CCOC(F)C(=O)N 34a_100121572206_100009813875 [1,0,0,0,0,0|2,0,1]=4 133 B7R0.5 CCOC(F)C(=O)[O-] 34a_100121572206_100020610796 [1,0,0,0,0,0|2,0,1]=4 134 B7R0.5 CCO[C@@H](C)C(=O)[O-] 7a_217856618621_100000210202 [1,0,0,0,0,0|1,0,1]=3 135 B7R0.5 CCO[C@H](C)C(=O)N 34a_100000731257_100000210202 [1,0,0,0,0,0|1,0,1]=3 136 B7R0.5 CCO[C@H](C)C(=O)N 7a_100000731257_100000210202 [1,0,0,0,0,0|1,0,1]=3 137 B7R0.5 CCSC(C)C(=O)C 1458a_100000230601_200000210301 [1,0,0,0,0,0|0,1,1]=3 138 B7R0.5 CCSC(C)C(=O)C 62a_100000210202_100009814033 [1,0,0,0,0,0|0,1,1]=3 139 B7R0.5 CCSC(C)C(=O)C 62a_100009814033_100000210202 [1,0,0,0,0,0|0,1,1]=3 140 B7R0.5 CCSC(C)C(=O)N 62a_100000210202_100000702099 [1,0,0,0,0,0|1,1,1]=4 141 B7R0.5 CCSC(C)C(=O)N 62a_100000702099_100000210202 [1,0,0,0,0,0|1,1,1]=4 142 B7R0.5 CCSC(C)C(=O)[13CH3] 1458a_100000230601_200025704644 [1,0,0,0,0,0|0,1,1]=3 143 B7R0.5 CNCC(C)C(=O)O 269956a_100000749485_200000210301 [1,0,0,0,0,0|3,0,0]=4 144 B7R0.5 CO/N=C(\C)/C(=O)C 1458a_100160996864_200000210301 [1,0,0,0,0,0|2,0,1]=4 145 B7R0.5 CO/N=C(\C)/C(=O)[13CH3] 1458a_100160996864_200025704644 [1,0,0,0,0,0|2,0,1]=4 146 B7R0.5 COCC(C)C(=O)C 1458a_100000070787_100000765312 [1,0,0,0,0,0|2,0,0]=3 147 B7R0.5 COCC(C)C(=O)C 1458a_100000751857_200000210301 [1,0,0,0,0,0|2,0,0]=3 148 B7R0.5 COCC(C)C(=O)C 34a_100000032740_200000210301 [1,0,0,0,0,0|2,0,0]=3 149 B7R0.5 COCC(C)C(=O)C 7a_100000032740_200000210301 [1,0,0,0,0,0|2,0,0]=3 150 B7R0.5 COCC(C)C(=O)[13CH3] 1458a_100000751857_200025704644 [1,0,0,0,0,0|2,0,0]=3 151 B7R0.5 CSCC(C)C(=O)C 1458a_100000753918_200000210301 [1,0,0,0,0,0|2,0,0]=3 152 B7R0.5 CSCC(C)C(=O)[13CH3] 1458a_100000753918_200025704644 [1,0,0,0,0,0|2,0,0]=3 153 B7R0.5 C[C@@H](OCF)C(=O)N 34a_100000731257_100015361967 [1,0,0,0,0,0|2,0,1]=4 154 B7R0.5 C[C@@H](OCF)C(=O)N 7a_100000731257_100015361967 [1,0,0,0,0,0|2,0,1]=4 155 B7R0.5 C[C@H](OCF)C(=O)[O-] 7a_217856618621_100015361967 [1,0,0,0,0,0|2,0,1]=4 156 B7R0.6 C=C(C)CCC(=O)C 1458a_100000070787_100000730704 [1,0,0,0,0,0|2,0,0]=3 157 B7R0.6 C=C(C)CCC(=O)C 1458a_200000688413_200000210301 [1,0,0,0,0,0|2,0,0]=3 158 B7R0.6 C=C(C)CCC(=O)[13CH3] 1458a_200000688413_200025704644 [1,0,0,0,0,0|2,0,0]=3 159 B7R0.6 C=C(C)CNC(=O)C 11a_100000765925_100015343762 [1,0,0,0,0,0|2,0,0]=3 160 B7R0.6 C=C(C)CNC(=O)C 1626a_100000765925_100015343762 [1,0,0,0,0,0|2,0,0]=3 161 B7R0.6 C=C(C)CNC(=O)C 240690a_100000765925_100015343762 [1,0,0,0,0,0|2,0,0]=3 162 B7R0.6 C=C(C)CNC(=O)C 527a_100000765925_100103153847 [1,0,0,0,0,0|2,0,0]=3 163 B7R0.6 C=C(C)COC(C)C 34a_100000210245_100000210206 [1,0,0,0,0,0|2,0,1]=4 164 B7R0.6 C=C(C)COC(C)C 34a_100000212225_100000748629 [1,0,0,0,0,0|2,0,1]=4 165 B7R0.6 CC(=CCC(=O)[13CH3])C 1458a_100011220947_200025704644 [1,0,0,0,0,0|2,0,0]=3 166 B7R0.6 CC(=O)CC=C(C)C 1458a_100000070787_100000761012 [1,0,0,0,0,0|2,0,0]=3 167 B7R0.6 CC(=O)CC=C(C)C 1458a_100011220947_200000210301 [1,0,0,0,0,0|2,0,0]=3 168 B7R0.6 CC(=O)CCC(=O)N 1458a_100011215257_200000210301 [1,0,0,0,0,0|2,0,0]=3 169 B7R0.6 CC(=O)CCC(C)C 1458a_100000070787_100000210312 [1,0,0,0,0,0|2,0,1]=4 170 B7R0.6 CC(=O)CCC(C)C 1458a_100000181311_200000210301 [1,0,0,0,0,0|2,0,1]=4 171 B7R0.6 CC(=O)CCC(C)O 1458a_100000070787_100012276601 [1,0,0,0,0,0|1,0,2]=4 172 B7R0.6 CC(=O)CCN(C)C 269982a_100102631434_100000053229 [1,0,0,0,0,0|3,0,0]=4 173 B7R0.6 CC(=O)CC[N+](=O)[O-] 1458a_200000064761_200000210301 [1,0,0,0,0,0|3,0,0]=4 174 B7R0.6 CC(=O)CC[S+](C)C 1458a_100009452791_200000210301 [1,0,0,0,0,0|3,0,0]=4 175 B7R0.6 CC(=O)CNC(=O)C 1458a_100000194580_200000210301 [1,0,0,0,0,0|1,0,0]=2 176 B7R0.6 CC(=O)CNC(=O)N 1458a_100000184981_200000210301 [1,0,0,0,0,0|2,0,0]=3 177 B7R0.6 CC(=O)COC(=O)C 1458a_100000183556_200000210301 [1,0,0,0,0,0|0,0,0]=1 178 B7R0.6 CC(=O)COC(C)C 1458a_100000745533_200000210301 [1,0,0,0,0,0|1,0,1]=3 179 B7R0.6 CC(=O)COC(C)C 34a_100000211253_100000210206 [1,0,0,0,0,0|1,0,1]=3 180 B7R0.6 CC(=O)COC(F)F 1458a_200000719455_200000210301 [1,0,0,0,0,0|2,0,1]=4 181 B7R0.6 CC(=O)CSC(=O)C 1458a_100000049016_200000210301 [1,0,0,0,0,0|0,1,0]=2 182 B7R0.6 CC(=O)CSC(C)C 1458a_100000241585_200000210301 [1,0,0,0,0,0|1,1,1]=4 183 B7R0.6 CC(=O)NCC(=O)N 11a_100000711301_100015343762 [1,0,0,0,0,0|2,0,0]=3 184 B7R0.6 CC(=O)NCC(=O)N 240690a_100000711301_100015343762 [1,0,0,0,0,0|2,0,0]=3 185 B7R0.6 CC(=O)NCC(=O)N 527a_100000711301_100103153847 [1,0,0,0,0,0|2,0,0]=3 186 B7R0.6 CC(=O)NCC(=O)[13CH3] 1458a_100000194580_200025704644 [1,0,0,0,0,0|1,0,0]=2 187 B7R0.6 CC(=O)NCC(C)C 11a_100000210953_100015343762 [1,0,0,0,0,0|2,0,1]=4 188 B7R0.6 CC(=O)NCC(C)C 1626a_100000210953_100015343762 [1,0,0,0,0,0|2,0,1]=4 189 B7R0.6 CC(=O)NCC(C)C 240690a_100000210953_100015343762 [1,0,0,0,0,0|2,0,1]=4 190 B7R0.6 CC(=O)NCC(C)C 527a_100000210953_100103153847 [1,0,0,0,0,0|2,0,1]=4 191 B7R0.6 CC(=O)NCC(C)O 11a_100000210904_100015343762 [1,0,0,0,0,0|1,0,2]=4 192 B7R0.6 CC(=O)NCC(C)O 240690a_100000210904_100015343762 [1,0,0,0,0,0|1,0,2]=4 193 B7R0.6 CC(=O)NCC(C)O 527a_100000210904_100103153847 [1,0,0,0,0,0|1,0,2]=4 194 B7R0.6 CC(=O)NNC(=O)C 22a_100000189765_100000070787 [1,0,0,0,0,0|2,0,0]=3 195 B7R0.6 CC(=O)OCC(=O)[13CH3] 1458a_100000183556_200025704644 [1,0,0,0,0,0|0,0,0]=1 196 B7R0.6 CC(=O)OCN(C)C 269982a_100102631434_100000076356 [1,0,0,0,0,0|2,0,0]=3 197 B7R0.6 CC(=O)SCC(=O)[13CH3] 1458a_100000049016_200025704644 [1,0,0,0,0,0|0,1,0]=2 198 B7R0.6 CC(C)CCC(=O)[13CH3] 1458a_100000181311_200025704644 [1,0,0,0,0,0|2,0,1]=4 199 B7R0.6 CC(C)OCC(=O)N 34a_100000212225_100000187820 [1,0,0,0,0,0|2,0,1]=4 200 B7R0.6 CC(C)OCC(=O)[13CH3] 1458a_100000745533_200025704644 [1,0,0,0,0,0|1,0,1]=3 201 B7R0.6 CC(C)OCC(=O)[O-] 34a_100000212225_100020667443 [1,0,0,0,0,0|2,0,1]=4 202 B7R0.6 CC(C)SCC(=O)[13CH3] 1458a_100000241585_200025704644 [1,0,0,0,0,0|1,1,1]=4 203 B7R0.6 C[S+](C)CCC(=O)[13CH3] 1458a_100009452791_200025704644 [1,0,0,0,0,0|3,0,0]=4 204 B7R0.6 [13CH3]C(=O)CCC(=O)N 1458a_100011215257_200025704644 [1,0,0,0,0,0|2,0,0]=3 205 B7R0.6 [13CH3]C(=O)CC[N+](=O)[O-] 1458a_200000064761_200025704644 [1,0,0,0,0,0|3,0,0]=4 206 B7R0.6 [13CH3]C(=O)CNC(=O)N 1458a_100000184981_200025704644 [1,0,0,0,0,0|2,0,0]=3 207 B7R0.6 [13CH3]C(=O)COC(F)F 1458a_200000719455_200025704644 [1,0,0,0,0,0|2,0,1]=4 208 B9R0.10 CC(=O)CN(C)S(=O)(=O)C 1458a_100000165953_200000210301 [0,1,0,0,0,0|3,0,0]=4 209 B9R0.10 CC(=O)N[C@@H](C)C(C)(C)O 11a_100025708725_100015343762 [0,1,0,0,0,0|1,0,2]=4 210 B9R0.10 CC(=O)N[C@@H](C)C(C)(C)O 1626a_100025708725_100015343762 [0,1,0,0,0,0|1,0,2]=4 211 B9R0.10 CC(=O)N[C@@H](C)C(C)(C)O 240690a_100025708725_100015343762 [0,1,0,0,0,0|1,0,2]=4 212 B9R0.10 CC(=O)N[C@@H](C)C(C)(C)O 527a_100025708725_100103153847 [0,1,0,0,0,0|1,0,2]=4 213 B9R0.10 CC(=O)N[C@H](C)C(C)(C)C 11a_100025703359_100015343762 [0,1,0,0,0,0|2,0,1]=4 214 B9R0.10 CC(=O)N[C@H](C)C(C)(C)C 1626a_100025703359_100015343762 [0,1,0,0,0,0|2,0,1]=4 215 B9R0.10 CC(=O)N[C@H](C)C(C)(C)C 240690a_100025703359_100015343762 [0,1,0,0,0,0|2,0,1]=4 216 B9R0.10 CC(=O)N[C@H](C)C(C)(C)C 527a_100025703359_100103153847 [0,1,0,0,0,0|2,0,1]=4 217 B9R0.10 CN(CC(=O)[13CH3])S(=O)(=O)C 1458a_100000165953_200025704644 [0,1,0,0,0,0|3,0,0]=4 218 B9R0.11 CC(=O)C(C)(C)OC(C)C 34a_100000747739_100000210206 [0,1,0,0,0,0|1,0,1]=3 219 B9R0.11 CC(=O)C(C)(C)OC(C)C 7a_100000747739_100000210206 [0,1,0,0,0,0|1,0,1]=3 220 B9R0.11 CC(=O)C(C)(C)SC(C)C 62a_100000075568_100000210206 [0,1,0,0,0,0|1,1,1]=4 221 B9R0.11 CC(=O)C(C)(C)SC(C)C 62a_100000210206_100000075568 [0,1,0,0,0,0|1,1,1]=4 222 B9R0.11 CC(=O)C(C)(O)CC(C)C 1458a_100011434877_200000210301 [0,1,0,0,0,0|2,0,1]=4 223 B9R0.11 CC(=O)NC(C)(C)C(=O)C 1458a_100000750020_200000210301 [0,1,0,0,0,0|1,0,0]=2 224 B9R0.11 CC(=O)NC(C)(C)C(=O)N 11a_100000743658_100015343762 [0,1,0,0,0,0|2,0,0]=3 225 B9R0.11 CC(=O)NC(C)(C)C(=O)N 240690a_100000743658_100015343762 [0,1,0,0,0,0|2,0,0]=3 226 B9R0.11 CC(=O)NC(C)(C)C(=O)N 527a_100000743658_100103153847 [0,1,0,0,0,0|2,0,0]=3 227 B9R0.11 CC(=O)NC(C)(C)C(=O)[13CH3] 1458a_100000750020_200025704644 [0,1,0,0,0,0|1,0,0]=2 228 B9R0.11 CC(=O)NC(C)(C)C(C)C 11a_200160471154_100015343762 [0,1,0,0,0,0|2,0,1]=4 229 B9R0.11 CC(=O)NC(C)(C)C(C)C 1626a_200160471154_100015343762 [0,1,0,0,0,0|2,0,1]=4 230 B9R0.11 CC(=O)NC(C)(C)C(C)C 240690a_200160471154_100015343762 [0,1,0,0,0,0|2,0,1]=4 231 B9R0.11 CC(=O)NC(C)(C)C(C)C 527a_200160471154_100103153847 [0,1,0,0,0,0|2,0,1]=4 232 B9R0.11 CC(=O)OC(C)(C)C(=O)C 1458a_200000137501_200000210301 [0,1,0,0,0,0|0,0,0]=1 233 B9R0.11 CC(=O)OC(C)(C)C(=O)[13CH3] 1458a_200000137501_200025704644 [0,1,0,0,0,0|0,0,0]=1 234 B9R0.11 CC(C)CC(C)(O)C(=O)[13CH3] 1458a_100011434877_200025704644 [0,1,0,0,0,0|2,0,1]=4 235 B9R0.11 CC(C)OC(C)(C)C(=O)N 34a_100000212225_100000702505 [0,1,0,0,0,0|2,0,1]=4 236 B9R0.11 CC(C)OC(C)(C)C(=O)N 34a_100011626353_100000210206 [0,1,0,0,0,0|2,0,1]=4 237 B9R0.11 CC(C)OC(C)(C)C(=O)N 7a_100011626353_100000210206 [0,1,0,0,0,0|2,0,1]=4 238 B9R0.23 C#CC(=O)C(C)OC(=O)C 1458a_100000211873_100009818208 [0,1,0,0,0,0|0,0,1]=2 239 B9R0.23 C=C(C)CN(C)C(=O)CC 11a_100000225649_100000210414 [0,1,0,0,0,0|3,0,0]=4 240 B9R0.23 C=C(C)CN(C)C(=O)CC 1626a_100000225649_100000210414 [0,1,0,0,0,0|3,0,0]=4 241 B9R0.23 C=C(C)CN(C)C(=O)CC 527a_100000225649_100000210414 [0,1,0,0,0,0|3,0,0]=4 242 B9R0.23 C=C(C)CN(C)C(=O)CO 527a_100000225649_100000210174 [0,1,0,0,0,0|3,0,0]=4 243 B9R0.23 C=C(C)CN(C)C(=O)NC 2708a_100102657272_100000225649 [0,1,0,0,0,0|3,0,0]=4 244 B9R0.23 C=C(C)CN(C)C(=O)NC 273464a_100102657272_100000225649 [0,1,0,0,0,0|3,0,0]=4 245 B9R0.23 C=C(NC(=O)C)C(=O)NC 240690a_100102657272_100000758921 [0,1,0,0,0,0|1,0,2]=4 246 B9R0.23 C=CC(=O)C(C)OC(=O)C 1458a_100000185746_100009818208 [0,1,0,0,0,0|0,0,1]=2 247 B9R0.23 CC(=O)N[C@H](C)C(=O)CF 1458a_100011504603_100015361967 [0,1,0,0,0,0|1,0,0]=2 248 B9R0.23 CC(=O)OC(C)C(=O)CO 1458a_100000210174_100009818208 [0,1,0,0,0,0|0,0,0]=1 249 B9R0.23 CC(=O)O[C@@H](C)C(=O)CF 1458a_100009816467_100015361967 [0,1,0,0,0,0|0,0,0]=1 250 B9R0.23 CC(C)CC(C)C(=O)CO 1458a_100000210174_100000731052 [0,1,0,0,0,0|2,0,1]=4 251 B9R0.23 CC(C)OC(C)C(=O)NN 34a_100000725659_100000210206 [0,1,0,0,0,0|2,0,1]=4 252 B9R0.23 CC(CN(C)C)C(=O)CF 1458a_200015186601_100015361967 [0,1,0,0,0,0|3,0,0]=4 253 B9R0.23 CCC(=O)C(C)CC(C)C 1458a_100000210414_100000731052 [0,1,0,0,0,0|2,0,1]=4 254 B9R0.23 CCC(=O)C(C)CN(C)C 1458a_200015186601_100000210202 [0,1,0,0,0,0|3,0,0]=4 255 B9R0.23 CCC(=O)C(C)NC(C)C 2230a_100138425928_100000742827 [0,1,0,0,0,0|2,0,1]=4 256 B9R0.23 CCC(=O)C(C)OC(=O)C 1458a_100000210414_100009818208 [0,1,0,0,0,0|0,0,0]=1 257 B9R0.23 CCC(=O)C(C)SC(C)C 62a_100000210206_100000742827 [0,1,0,0,0,0|1,1,1]=4 258 B9R0.23 CCC(=O)C(C)SC(C)C 62a_100000742827_100000210206 [0,1,0,0,0,0|1,1,1]=4 259 B9R0.23 CCC(=O)N(C)CC(=O)N 11a_100000739694_100000210414 [0,1,0,0,0,0|3,0,0]=4 260 B9R0.23 CCC(=O)N(C)CC(=O)N 527a_100000739694_100000210414 [0,1,0,0,0,0|3,0,0]=4 261 B9R0.23 CCC(=O)[C@@H](C)NC(=O)C 1458a_100011504603_100000210202 [0,1,0,0,0,0|1,0,0]=2 262 B9R0.23 CCC(=O)[C@H](C)OC(=O)C 1458a_100009816467_100000210202 [0,1,0,0,0,0|0,0,0]=1 263 B9R0.23 CCN(C)C(C)CC(=O)C 1458a_200015187196_200000210301 [0,1,0,0,0,0|3,0,0]=4 264 B9R0.23 CCN(C)C(C)CC(=O)[13CH3] 1458a_200015187196_200025704644 [0,1,0,0,0,0|3,0,0]=4 265 B9R0.23 CCN(C)C(C)OC(=O)C 269982a_100000225621_100009818208 [0,1,0,0,0,0|2,0,0]=3 266 B9R0.23 CN(CC(=O)N)C(=O)CO 527a_100000739694_100000210174 [0,1,0,0,0,0|3,0,0]=4 267 B9R0.23 CNC(=O)C(C)CN(C)C 1626a_100102657272_200015186601 [0,1,0,0,0,0|3,0,0]=4 268 B9R0.23 CNC(=O)C(C)CN(C)C 240690a_100102657272_200015186601 [0,1,0,0,0,0|3,0,0]=4 269 B9R0.23 CNC(=O)C(C)NC(C)C 2230a_100138425928_100000731044 [0,1,0,0,0,0|2,0,1]=4 270 B9R0.23 CNC(=O)C(C)NC(C)C 34a_100138425928_100000731044 [0,1,0,0,0,0|2,0,1]=4 271 B9R0.23 CNC(=O)C(C)OC(C)C 34a_100000212225_100000731044 [0,1,0,0,0,0|1,0,1]=3 272 B9R0.23 CNC(=O)C(C)SC(C)C 62a_100000209862_100000210206 [0,1,0,0,0,0|1,1,1]=4 273 B9R0.23 CNC(=O)C(C)SC(C)C 62a_100000210206_100000731044 [0,1,0,0,0,0|1,1,1]=4 274 B9R0.23 CNC(=O)C(F)OC(C)C 34a_100000212225_100009813575 [0,1,0,0,0,0|2,0,1]=4 275 B9R0.23 CNC(=O)N(C)CC(=O)N 2708a_100102657272_100000739694 [0,1,0,0,0,0|3,0,0]=4 276 B9R0.23 CNC(=O)N(C)CC(=O)N 273464a_100102657272_100000739694 [0,1,0,0,0,0|3,0,0]=4 277 B9R0.23 CNC(=O)[C@@H](C)NC(=O)C 11a_100000684985_100015343762 [0,1,0,0,0,0|1,0,0]=2 278 B9R0.23 CNC(=O)[C@@H](C)NC(=O)C 11a_106832991635_100011504603 [0,1,0,0,0,0|1,0,0]=2 279 B9R0.23 CNC(=O)[C@@H](C)NC(=O)C 1626a_100102657272_100011504603 [0,1,0,0,0,0|1,0,0]=2 280 B9R0.23 CNC(=O)[C@@H](C)NC(=O)C 240690a_100000684985_100015343762 [0,1,0,0,0,0|1,0,0]=2 281 B9R0.23 CNC(=O)[C@@H](C)NC(=O)C 240690a_100102657272_100011504603 [0,1,0,0,0,0|1,0,0]=2 282 B9R0.23 CNC(=O)[C@@H](C)NC(=O)C 527a_100000684985_100103153847 [0,1,0,0,0,0|1,0,0]=2 283 B9R0.23 CNC(=O)[C@@H](C)NC(=O)C 527a_100102657272_100011504603 [0,1,0,0,0,0|1,0,0]=2 284 B9R0.23 CNC(=O)[C@@H](C)NC(C)C 2230a_100000684985_100000210206 [0,1,0,0,0,0|2,0,1]=4 285 B9R0.23 CNC(=O)[C@@H](C)NC(C)C 34a_100000684985_100000210206 [0,1,0,0,0,0|2,0,1]=4 286 B9R0.23 CNC(=O)[C@H](C)OC(=O)C 11a_106832991635_100009816467 [0,1,0,0,0,0|0,0,0]=1 287 B9R0.23 CNC(=O)[C@H](C)OC(=O)C 1626a_100102657272_100009816467 [0,1,0,0,0,0|0,0,0]=1 288 B9R0.23 CNC(=O)[C@H](C)OC(=O)C 240690a_100102657272_100009816467 [0,1,0,0,0,0|0,0,0]=1 289 B9R0.23 CNC(=O)[C@H](C)OC(=O)C 527a_100102657272_100009816467 [0,1,0,0,0,0|0,0,0]=1 290 B9R0.23 COC(=O)C(C)CN(C)C 269982a_100102631434_100000698445 [0,1,0,0,0,0|3,0,0]=4 291 B9R0.23 COC(=O)C(C)NC(C)C 2230a_100138425928_100000211248 [0,1,0,0,0,0|2,0,1]=4 292 B9R0.23 COC(=O)C(C)NC(C)C 34a_100138425928_100000211248 [0,1,0,0,0,0|2,0,1]=4 293 B9R0.23 COC(=O)C(C)OC(C)C 34a_100000212225_100000211248 [0,1,0,0,0,0|1,0,1]=3 294 B9R0.23 COC(=O)C(C)OC(C)C 34a_100011215400_100000210206 [0,1,0,0,0,0|1,0,1]=3 295 B9R0.23 COC(=O)C(C)SC(C)C 62a_100000210206_100000211248 [0,1,0,0,0,0|1,1,1]=4 296 B9R0.23 COC(=O)C(C)SC(C)C 62a_100000211248_100000210206 [0,1,0,0,0,0|1,1,1]=4 297 B9R0.23 COC(=O)[C@@H](C)NC(=O)C 188690a_100000687819_100015343762 [0,1,0,0,0,0|1,0,0]=2 298 B9R0.39 C=C(C)CC(OC)C(=C)C 34a_200000034272_200000210301 [0,1,0,0,0,0|3,0,0]=4 299 B9R0.39 C=C(C)CC(OC)C(=C)C 7a_200000034272_200000210301 [0,1,0,0,0,0|3,0,0]=4 300 B9R0.39 C=C(C)CC(O[13CH3])C(=C)C 34a_200000034272_200025704644 [0,1,0,0,0,0|3,0,0]=4 301 B9R0.39 C=C(C)CC(O[13CH3])C(=C)C 7a_200000034272_200025704644 [0,1,0,0,0,0|3,0,0]=4 302 B9R0.39 C=C(C)CN(CC)C(=O)C 11a_100000211296_100015343762 [0,1,0,0,0,0|3,0,0]=4 303 B9R0.39 C=C(C)CN(CC)C(=O)C 1626a_100000211296_100015343762 [0,1,0,0,0,0|3,0,0]=4 304 B9R0.39 C=C(C)CN(CC)C(=O)C 527a_100000211296_100103153847 [0,1,0,0,0,0|3,0,0]=4 305 B9R0.39 CC(=O)NC(C#N)C(=O)N 1626a_100000039599_100015343762 [0,1,0,0,0,0|2,0,1]=4 306 B9R0.39 CC(=O)NC(CO)C(=O)C 1458a_200011194110_200000210301 [0,1,0,0,0,0|1,0,0]=2 307 B9R0.39 CC(=O)NC(CO)C(=O)[13CH3] 1458a_200011194110_200025704644 [0,1,0,0,0,0|1,0,0]=2 308 B9R0.39 CC(=O)N[C@@H](CO)C(=O)N 240690a_100000729942_100015343762 [0,1,0,0,0,0|2,0,0]=3 309 B9R0.39 CC(=O)N[C@@H](CO)C(C)C 240690a_100011830312_100015343762 [0,1,0,0,0,0|2,0,1]=4 310 B9R0.39 CC(=O)N[C@@H](CO)C(C)C 527a_100011830312_100103153847 [0,1,0,0,0,0|2,0,1]=4 311 B9R0.39 CC(=O)N[C@H](CO)[C@@H](C)O 240690a_100015196842_100015343762 [0,1,0,0,0,0|1,0,2]=4 312 B9R0.39 CC(=O)N[C@H](CO)[C@@H](C)O 527a_100015196842_100103153847 [0,1,0,0,0,0|1,0,2]=4 313 B9R0.39 CCC(NC(=O)C)C(=O)C 1458a_100000195128_200000210301 [0,1,0,0,0,0|1,0,0]=2 314 B9R0.39 CCC(NC(=O)C)C(=O)N 11a_100000733705_100015343762 [0,1,0,0,0,0|2,0,0]=3 315 B9R0.39 CCC(NC(=O)C)C(=O)N 1626a_100000733705_100015343762 [0,1,0,0,0,0|2,0,0]=3 316 B9R0.39 CCC(NC(=O)C)C(=O)N 240690a_100000733705_100015343762 [0,1,0,0,0,0|2,0,0]=3 317 B9R0.39 CCC(NC(=O)C)C(=O)N 527a_100000733705_100103153847 [0,1,0,0,0,0|2,0,0]=3 318 B9R0.39 CCC(NC(=O)C)C(=O)[13CH3] 1458a_100000195128_200025704644 [0,1,0,0,0,0|1,0,0]=2 319 B9R0.39 CCC(NC(=O)C)C(C)C 11a_100000745074_100015343762 [0,1,0,0,0,0|2,0,1]=4 320 B9R0.39 CCC(NC(=O)C)C(C)C 1626a_100000745074_100015343762 [0,1,0,0,0,0|2,0,1]=4 321 B9R0.39 CCC(NC(=O)C)C(C)C 240690a_100000745074_100015343762 [0,1,0,0,0,0|2,0,1]=4 322 B9R0.39 CCC(NC(=O)C)C(C)C 527a_100000745074_100103153847 [0,1,0,0,0,0|2,0,1]=4 323 B9R0.39 CCC(NC(=O)N)C(=O)C 1458a_100000203762_200000210301 [0,1,0,0,0,0|2,0,0]=3 324 B9R0.39 CCC(NC(=O)N)C(=O)[13CH3] 1458a_100000203762_200025704644 [0,1,0,0,0,0|2,0,0]=3 325 B9R0.39 CCC(OC(C)C)C(=O)N 34a_100000212225_100000750255 [0,1,0,0,0,0|2,0,1]=4 326 B9R0.39 CC[C@H](NC(=O)C)[C@@H](C)O 11a_100161114882_100015343762 [0,1,0,0,0,0|1,0,2]=4 327 B9R0.39 CC[C@H](NC(=O)C)[C@@H](C)O 1626a_100161114882_100015343762 [0,1,0,0,0,0|1,0,2]=4 328 B9R0.39 CC[C@H](NC(=O)C)[C@@H](C)O 240690a_100161114882_100015343762 [0,1,0,0,0,0|1,0,2]=4 329 B9R0.39 CC[C@H](NC(=O)C)[C@@H](C)O 527a_100161114882_100103153847 [0,1,0,0,0,0|1,0,2]=4 330 B9R0.39 CN[C@@H](CC(=O)N)C(=O)N 2230a_100000143228_200000210301 [0,1,0,0,0,0|3,0,0]=4 331 B9R0.39 CN[C@@H](CS(=O)C)C(=O)O 269956a_100009817418_200000210301 [0,1,0,0,0,0|3,0,0]=4 332 B9R0.39 CS(=O)C[C@H](N[13CH3])C(=O)O 269956a_100009817418_200025704644 [0,1,0,0,0,0|3,0,0]=4 333 B9R0.39 [13CH3]N[C@@H](CC(=O)N)C(=O)N 2230a_100000143228_200025704644 [0,1,0,0,0,0|3,0,0]=4 334 B9R0.42 C#CC(C)NC(C)C(=O)C 2230a_100000707721_100009814033 [0,1,0,0,0,0|2,0,1]=4 335 B9R0.42 C#CC(C)OC(C)C(=O)C 34a_100000212229_200000035995 [0,1,0,0,0,0|1,0,1]=3 336 B9R0.42 C#CC(C)O[C@H](C)C(=O)N 34a_100000731257_200000035995 [0,1,0,0,0,0|2,0,1]=4 337 B9R0.42 C#CC(C)SC(C)C(=O)C 62a_200000035995_100009814033 [0,1,0,0,0,0|1,1,1]=4 338 B9R0.42 C#C[C@@H](C)OC(C)C(=O)C 7a_100009815206_100000179758 [0,1,0,0,0,0|1,0,1]=3 339 B9R0.42 C#C[C@@H](C)OC(C)C(=O)N 34a_100009815206_100000702099 [0,1,0,0,0,0|2,0,1]=4 340 B9R0.42 C#C[C@@H](C)OC(C)C(=O)N 7a_100009815206_100000702099 [0,1,0,0,0,0|2,0,1]=4 341 B9R0.42 C=CC(=O)N[C@H](C)C(=O)N 240690a_100000119354_200121576911 [0,1,0,0,0,0|2,0,1]=4 342 B9R0.42 C=CC(C)OC(C)C(=O)N 34a_100000695699_100000702099 [0,1,0,0,0,0|2,0,1]=4 343 B9R0.42 C=CC(C)SC(C)C(=O)C 62a_100011215867_100009814033 [0,1,0,0,0,0|1,1,1]=4 344 B9R0.42 CC(=O)C(=O)CC(=O)CO 1458a_100000210174_100011261029 [0,1,0,0,0,0|2,0,1]=4 345 B9R0.42 CC(=O)C(C)NC(C)C#N 2230a_100000737613_100009814033 [0,1,0,0,0,0|2,0,1]=4 346 B9R0.42 CC(=O)C(C)N[C@H](C)CO 2230a_100000737577_100009814033 [0,1,0,0,0,0|1,0,2]=4 347 B9R0.42 CC(=O)C(C)OC(C)CF 7a_100016041109_100000179758 [0,1,0,0,0,0|1,0,1]=3 348 B9R0.42 CC(=O)C(C)OC(C)CO 34a_100000212229_100012180447 [0,1,0,0,0,0|0,0,2]=3 349 B9R0.42 CC(=O)C(C)SC(C)C#N 62a_100000703298_100009814033 [0,1,0,0,0,0|1,1,1]=4 350 B9R0.42 CC(=O)C(C)SC(C)C#N 62a_100009814033_100000703298 [0,1,0,0,0,0|1,1,1]=4 351 B9R0.42 CC(=O)C(C)SC(C)CO 62a_100012180447_100009814033 [0,1,0,0,0,0|0,1,2]=4 352 B9R0.42 CC(=O)C(C)S[C@H](C)CO 62a_100009814033_100016084084 [0,1,0,0,0,0|0,1,2]=4 353 B9R0.42 CC(=O)C(C)S[C@H](C)CO 62a_100016084084_100009814033 [0,1,0,0,0,0|0,1,2]=4 354 B9R0.42 CC(=O)N(C)CC(=O)CF 1458a_100000194957_100015361967 [0,1,0,0,0,0|2,0,0]=3 355 B9R0.42 CC(C#N)OC(C)C(=O)N 34a_100011218135_100000702099 [0,1,0,0,0,0|2,0,1]=4 356 B9R0.42 CC(C#N)O[C@@H](C)C(=O)[O-] 7a_217856618621_100000703298 [0,1,0,0,0,0|2,0,1]=4 357 B9R0.42 CC(C#N)O[C@H](C)C(=O)N 7a_100000731257_100000703298 [0,1,0,0,0,0|2,0,1]=4 358 B9R0.42 CC(C)C(C)NC(=O)CO 240690a_100000211541_100000210174 [0,1,0,0,0,0|2,0,1]=4 359 B9R0.42 CC(C)C(C)NC(=O)CO 527a_100000211541_100000210174 [0,1,0,0,0,0|2,0,1]=4 360 B9R0.42 CC(CC(=O)CF)N(C)C 1458a_100011311895_100015361967 [0,1,0,0,0,0|3,0,0]=4 361 B9R0.42 CC(CF)OC(C)C(=O)N 34a_100016041109_100000702099 [0,1,0,0,0,0|2,0,1]=4 362 B9R0.42 CC(CF)OC(C)C(=O)N 7a_100016041109_100000702099 [0,1,0,0,0,0|2,0,1]=4 363 B9R0.42 CC(CN)OC(C)C(=O)N 34a_100000210904_100000702099 [0,1,0,0,0,0|2,0,1]=4 364 B9R0.42 CC(CO)O[C@@H](C)C(=O)[O-] 7a_217856618621_100012180447 [0,1,0,0,0,0|1,0,2]=4 365 B9R0.42 CC(CO)O[C@H](C)C(=O)N 34a_100000731257_100012180447 [0,1,0,0,0,0|1,0,2]=4 366 B9R0.42 CC(CO)O[C@H](C)C(=O)N 7a_100000731257_100012180447 [0,1,0,0,0,0|1,0,2]=4 367 B9R0.42 CCC(=O)CC(=O)C(=O)C 1458a_100000210414_100011261029 [0,1,0,0,0,0|2,0,1]=4 368 B9R0.42 CCC(=O)CC(C)N(C)C 1458a_100011311895_100000210202 [0,1,0,0,0,0|3,0,0]=4 369 B9R0.42 CCC(=O)CN(C)C(=O)C 1458a_100000194957_100000210202 [0,1,0,0,0,0|2,0,0]=3 370 B9R0.42 CCC(=O)CN(C)C(=O)N 1458a_100000218718_100000210202 [0,1,0,0,0,0|3,0,0]=4 371 B9R0.42 CCC(=O)NC(C)C(=O)C 1458a_100000194823_200000210301 [0,1,0,0,0,0|1,0,0]=2 372 B9R0.42 CCC(=O)NC(C)C(=O)[13CH3] 1458a_100000194823_200025704644 [0,1,0,0,0,0|1,0,0]=2 373 B9R0.42 CCC(=O)NC(C)C(C)C 11a_100000211541_100000210414 [0,1,0,0,0,0|2,0,1]=4 374 B9R0.42 CCC(=O)NC(C)C(C)C 1626a_100000211541_100000210414 [0,1,0,0,0,0|2,0,1]=4 375 B9R0.42 CCC(=O)NC(C)C(C)C 240690a_100000211541_100000210414 [0,1,0,0,0,0|2,0,1]=4 376 B9R0.42 CCC(=O)NC(C)C(C)C 527a_100000211541_100000210414 [0,1,0,0,0,0|2,0,1]=4 377 B9R0.42 CCC(=O)N[C@H](C)C(=O)N 11a_100000119354_100000210414 [0,1,0,0,0,0|2,0,0]=3 378 B9R0.42 CCC(=O)N[C@H](C)C(=O)N 240690a_100000119354_100000210414 [0,1,0,0,0,0|2,0,0]=3 379 B9R0.42 CCC(=O)N[C@H](C)C(=O)N 527a_100000119354_100000210414 [0,1,0,0,0,0|2,0,0]=3 380 B9R0.42 CCC(C)NC(C)C(=O)C 2230a_100000209981_100009814033 [0,1,0,0,0,0|2,0,1]=4 381 B9R0.42 CCC(C)OC(C)C(=O)C 34a_100000212229_100011215416 [0,1,0,0,0,0|1,0,1]=3 382 B9R0.42 CCC(C)OC(C)C(=O)C 7a_100000210228_100000179758 [0,1,0,0,0,0|1,0,1]=3 383 B9R0.42 CCC(C)OC(C)C(=O)N 7a_100000210228_100000702099 [0,1,0,0,0,0|2,0,1]=4 384 B9R0.42 CCC(C)O[C@@H](C)C(=O)[O-] 7a_217856618621_100000758301 [0,1,0,0,0,0|2,0,1]=4 385 B9R0.42 CCC(C)O[C@H](C)C(=O)N 34a_100000731257_100011215416 [0,1,0,0,0,0|2,0,1]=4 386 B9R0.42 CCC(C)O[C@H](C)C(=O)N 7a_100000731257_100000758301 [0,1,0,0,0,0|2,0,1]=4 387 B9R0.42 CCC(C)SC(C)C(=O)C 62a_100000758301_100009814033 [0,1,0,0,0,0|1,1,1]=4 388 B9R0.42 CCC(C)SC(C)C(=O)C 62a_100009814033_100000758301 [0,1,0,0,0,0|1,1,1]=4 389 B9R0.42 CCN(C)CC(C)C(=O)C 1458a_200015185930_200000210301 [0,1,0,0,0,0|3,0,0]=4 390 B9R0.42 CCN(C)CC(C)C(=O)[13CH3] 1458a_200015185930_200025704644 [0,1,0,0,0,0|3,0,0]=4 391 B9R0.42 CN(CC(=O)CF)C(=O)N 1458a_100000218718_100015361967 [0,1,0,0,0,0|3,0,0]=4 392 B9R0.42 CNC(=O)CC(C)N(C)C 1626a_100102657272_100011311895 [0,1,0,0,0,0|3,0,0]=4 393 B9R0.42 CNC(=O)CC(C)N(C)C 2230a_100015186911_200000210301 [0,1,0,0,0,0|3,0,0]=4 394 B9R0.42 CNC(=O)CC(C)N(C)C 240690a_100102657272_100011311895 [0,1,0,0,0,0|3,0,0]=4 395 B9R0.42 CNC(=O)CC(C)N(C)C 269982a_100015186911_200000210301 [0,1,0,0,0,0|3,0,0]=4 396 B9R0.42 CNC(=O)CC(C)N(C)[13CH3] 2230a_100015186911_200025704644 [0,1,0,0,0,0|3,0,0]=4 397 B9R0.42 CNC(=O)CC(C)N(C)[13CH3] 269982a_100015186911_200025704644 [0,1,0,0,0,0|3,0,0]=4 398 B9R0.42 CNC(=O)CN(C)C(=O)C 11a_100000189611_100015343762 [0,1,0,0,0,0|2,0,0]=3 399 B9R0.42 CNC(=O)CN(C)C(=O)C 11a_106832991635_100000194957 [0,1,0,0,0,0|2,0,0]=3 400 B9R0.42 CNC(=O)CN(C)C(=O)C 1626a_100102657272_100000194957 [0,1,0,0,0,0|2,0,0]=3 401 B9R0.42 CNC(=O)CN(C)C(=O)C 240690a_100000189611_100015343762 [0,1,0,0,0,0|2,0,0]=3 402 B9R0.42 CNC(=O)CN(C)C(=O)C 240690a_100102657272_100000194957 [0,1,0,0,0,0|2,0,0]=3 403 B9R0.42 CNC(=O)CN(C)C(=O)C 527a_100000189611_100103153847 [0,1,0,0,0,0|2,0,0]=3 404 B9R0.42 CNC(=O)CN(C)C(=O)C 527a_100102657272_100000194957 [0,1,0,0,0,0|2,0,0]=3 405 B9R0.42 CNC(=O)CN(C)C(=O)N 240690a_100102657272_100000218718 [0,1,0,0,0,0|3,0,0]=4 406 B9R0.42 CNC(=O)NC(C)C(C)C 2708a_100000211541_106832991635 [0,1,0,0,0,0|2,0,1]=4 407 B9R0.42 CNC(=O)NC(C)C(C)C 2708a_100102657272_100000211541 [0,1,0,0,0,0|2,0,1]=4 408 B9R0.42 CNC(=O)NC(C)C(C)C 273464a_100000211541_100102657272 [0,1,0,0,0,0|2,0,1]=4 409 B9R0.42 CNC(=O)NC(C)C(C)C 273464a_100102657272_100000211541 [0,1,0,0,0,0|2,0,1]=4 410 B9R0.42 CNC(=O)NC(C)C(C)C 512a_100000211541_100102657272 [0,1,0,0,0,0|2,0,1]=4 411 B9R0.42 CNC(=O)NC(C)C(C)C 512a_106832991638_100000211541 [0,1,0,0,0,0|2,0,1]=4 412 B9R0.42 CNC(=O)N[C@H](C)C(=O)N 273464a_100000119354_100102657272 [0,1,0,0,0,0|2,0,0]=3 413 B9R0.42 CNC(=O)N[C@H](C)C(=O)N 273464a_100102657272_100000119354 [0,1,0,0,0,0|2,0,0]=3 414 B9R0.42 CNC(=O)N[C@H](C)C(=O)N 512a_100000119354_100102657272 [0,1,0,0,0,0|2,0,0]=3 415 B9R0.42 CNC(=O)N[C@H](C)C(=O)N 512a_106832991638_100000119354 [0,1,0,0,0,0|2,0,0]=3 416 B9R0.42 COC(=O)CC(C)C(=O)C 1458a_100000037256_200000210301 [0,1,0,0,0,0|1,0,0]=2 417 B9R0.42 COC(=O)CC(C)C(=O)[13CH3] 1458a_100000037256_200025704644 [0,1,0,0,0,0|1,0,0]=2 418 B9R0.42 COC(=O)CC(C)N(C)C 2230a_100102631434_100009817358 [0,1,0,0,0,0|3,0,0]=4 419 B9R0.42 COC(=O)CC(C)N(C)C 269982a_100102631434_100009817358 [0,1,0,0,0,0|3,0,0]=4 420 B9R0.42 COC(=O)CN(C)C(=O)C 11a_100000198492_100015343762 [0,1,0,0,0,0|2,0,0]=3 421 B9R0.42 COC(=O)CN(C)C(=O)C 1626a_100000198492_100015343762 [0,1,0,0,0,0|2,0,0]=3 422 B9R0.42 COC(=O)CN(C)C(=O)C 240690a_100000198492_100015343762 [0,1,0,0,0,0|2,0,0]=3 423 B9R0.42 COC(=O)CN(C)C(=O)C 527a_100000198492_100103153847 [0,1,0,0,0,0|2,0,0]=3 424 B9R0.42 COC(C)SC(C)C(=O)C 62a_100009814033_100009879195 [0,1,0,0,0,0|0,1,2]=4 425 B9R0.42 COC(C)SC(C)C(=O)C 62a_100009879195_100009814033 [0,1,0,0,0,0|0,1,2]=4 426 B9R0.42 C[C@@H](NC(=O)CO)C(=O)N 240690a_100000119354_100000210174 [0,1,0,0,0,0|2,0,0]=3 427 B9R0.42 C[C@@H](NC(=O)CO)C(=O)N 527a_100000119354_100000210174 [0,1,0,0,0,0|2,0,0]=3 428 B9R0.57 CC(=O)C(C)NC(C)(C)C 2230a_100000715429_100009814033 [0,1,0,0,0,0|2,0,1]=4 429 B9R0.57 CC(=O)C(C)OC(C)(C)C 34a_100000212229_100000210625 [0,1,0,0,0,0|1,0,1]=3 430 B9R0.57 CC(=O)C(C)OC(C)(C)C 7a_100015890283_100000179758 [0,1,0,0,0,0|1,0,1]=3 431 B9R0.57 CC(=O)C(C)OC(F)(F)F 34a_100000212229_200103152311 [0,1,0,0,0,0|2,0,1]=4 432 B9R0.57 CC(=O)C(C)SC(C)(C)C 62a_100000211941_100009814033 [0,1,0,0,0,0|1,1,1]=4 433 B9R0.57 CC(=O)C(C)SC(C)(C)C 62a_100009814033_100000211941 [0,1,0,0,0,0|1,1,1]=4 434 B9R0.57 CC(=O)[C@H](C)OS(=O)(=O)C 1458a_200015292407_200000210301 [0,1,0,0,0,0|1,0,0]=2 435 B9R0.57 CC(OC(C)(C)C)C(=O)N 34a_100015890283_100000702099 [0,1,0,0,0,0|2,0,1]=4 436 B9R0.57 CC(OC(C)(C)C)C(=O)N 7a_100015890283_100000702099 [0,1,0,0,0,0|2,0,1]=4 437 B9R0.57 C[C@@H](NS(=O)(=O)C)C(=O)N 40a_100000119354_100000738038 [0,1,0,0,0,0|3,0,0]=4 438 B9R0.57 C[C@@H](OC(C)(C)C)C(=O)N 34a_100000731257_100000210625 [0,1,0,0,0,0|2,0,1]=4 439 B9R0.57 C[C@H](OS(=O)(=O)C)C(=O)[13CH3] 1458a_200015292407_200025704644 [0,1,0,0,0,0|1,0,0]=2 440 B9R0.79 C=C(C)C(=O)C(C)C(=O)C 1458a_100000185857_100000179758 [0,1,0,0,0,0|2,0,0]=3 441 B9R0.79 C=C(C)C(=O)C(C)C(=O)N 1458a_100000185857_100000702099 [0,1,0,0,0,0|3,0,0]=4 442 B9R0.79 CC(=O)C(C)C(=O)C(C)C 1458a_100000070787_100009893295 [0,1,0,0,0,0|2,0,1]=4 443 B9R0.79 CC(=O)C(C)C(=O)C(C)C 1458a_100000210198_100000179758 [0,1,0,0,0,0|2,0,1]=4 444 B9R0.79 CC(=O)C(C)C(=O)C(C)F 1458a_100000062450_100000179758 [0,1,0,0,0,0|2,0,1]=4 445 B9R0.79 CC(=O)C(C)C(=O)N(C)C 1458a_100000070787_100000209910 [0,1,0,0,0,0|3,0,0]=4 446 B9R0.79 CC(=O)C(C)C(=O)[C@@H](C)O 1458a_100000717761_100000179758 [0,1,0,0,0,0|1,0,2]=4 447 B9R0.79 CC(=O)C(C)C(=O)[C@H](C)O 1458a_217856618621_100000179758 [0,1,0,0,0,0|1,0,2]=4 448 B9R0.79 CC(=O)C(C)N(C)C(C)C 269982a_200000211004_100009814033 [0,1,0,0,0,0|2,0,1]=4 449 B9R0.79 CC(=O)N(C)C(C)C(C)C 11a_100000228512_100015343762 [0,1,0,0,0,0|2,0,1]=4 450 B9R0.79 CC(=O)N(C)C(C)C(C)C 1626a_100000228512_100015343762 [0,1,0,0,0,0|2,0,1]=4 451 B9R0.79 CC(=O)N(C)C(C)C(C)C 240690a_100000228512_100015343762 [0,1,0,0,0,0|2,0,1]=4 452 B9R0.79 CC(=O)N(C)C(C)C(C)C 527a_100000228512_100103153847 [0,1,0,0,0,0|2,0,1]=4 453 B9R1.35 CC(=O)C1CC(=NO1)C 1458a_100000763720_200000210301 [0,0,0,1,0,0|3,0,0]=4 454 B9R1.35 CC(=O)C1CCC(=O)N1 1458a_100000210400_200000210301 [0,0,0,1,0,0|1,0,0]=2 455 B9R1.35 CC(=O)C1CCC(C1)O 1458a_100000688591_200000210301 [0,0,0,1,0,0|1,0,2]=4 456 B9R1.35 CC(=O)C1CCN(C1)C 1458a_100000739633_200000210301 [0,0,0,1,0,0|3,0,0]=4 457 B9R1.35 CC(=O)C1CNC(=O)C1 1458a_100000747279_200000210301 [0,0,0,1,0,0|2,0,0]=3 458 B9R1.35 CC(=O)C1CNC(=O)N1 1458a_100000033324_200000210301 [0,0,0,1,0,0|2,0,0]=3 459 B9R1.35 CC(=O)C1CSC(=N1)N 1458a_100000002200_200000210301 [0,0,0,1,0,0|2,1,0]=4 460 B9R1.35 CC(=O)N1CNC(=O)C1 11a_200000708111_100015343762 [0,0,0,1,0,0|3,0,0]=4 461 B9R1.35 CC(=O)N1CNC(=O)C1 1626a_200000708111_100015343762 [0,0,0,1,0,0|3,0,0]=4 462 B9R1.35 CC(=O)N1CNC(=O)C1 240690a_200000708111_100015343762 [0,0,0,1,0,0|3,0,0]=4 463 B9R1.35 CC(=O)N1CNC(=O)C1 527a_200000708111_100103153847 [0,0,0,1,0,0|3,0,0]=4 464 B9R1.35 CC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_200000210301 [0,0,0,1,0,0|0,0,0]=1 465 B9R1.35 CC(=O)[C@@H]1CSC(=O)N1 1458a_100000735014_200000210301 [0,0,0,1,0,0|2,0,0]=3 466 B9R1.35 CC1=NOC(C1)C(=O)[13CH3] 1458a_100000763720_200025704644 [0,0,0,1,0,0|3,0,0]=4 467 B9R1.35 CN1CCC(C1)C(=O)[13CH3] 1458a_100000739633_200025704644 [0,0,0,1,0,0|3,0,0]=4 468 B9R1.35 [13CH3]C(=O)C1CCC(=O)N1 1458a_100000210400_200025704644 [0,0,0,1,0,0|1,0,0]=2 469 B9R1.35 [13CH3]C(=O)C1CCC(C1)O 1458a_100000688591_200025704644 [0,0,0,1,0,0|1,0,2]=4 470 B9R1.35 [13CH3]C(=O)C1CNC(=O)C1 1458a_100000747279_200025704644 [0,0,0,1,0,0|2,0,0]=3 471 B9R1.35 [13CH3]C(=O)C1CNC(=O)N1 1458a_100000033324_200025704644 [0,0,0,1,0,0|2,0,0]=3 472 B9R1.35 [13CH3]C(=O)C1CSC(=N1)N 1458a_100000002200_200025704644 [0,0,0,1,0,0|2,1,0]=4 473 B9R1.35 [13CH3]C(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_200025704644 [0,0,0,1,0,0|0,0,0]=1 474 B9R1.35 [13CH3]C(=O)[C@@H]1CSC(=O)N1 1458a_100000735014_200025704644 [0,0,0,1,0,0|2,0,0]=3 475 B9R1.55 CC(=O)N1C[C@@H]([C@@H]1C)O 11a_206633788156_100015343762 [0,0,0,1,0,0|1,0,2]=4 476 B9R1.55 CC(=O)N1C[C@@H]([C@@H]1C)O 240690a_206633788156_100015343762 [0,0,0,1,0,0|1,0,2]=4 477 B9R1.55 CC(=O)N1C[C@@H]([C@@H]1C)O 527a_206633788156_100103153847 [0,0,0,1,0,0|1,0,2]=4 478 B9R1.67 CC(C)NC1CCC1=O 34a_100138425928_100009892977 [0,0,0,1,0,0|2,0,1]=4 479 B9R1.67 CC(C)OC1CCC1=O 34a_100000212225_100009892977 [0,0,0,1,0,0|1,0,1]=3 480 B9R1.67 CC(C)SC1CCC1=O 62a_100000210206_100009892977 [0,0,0,1,0,0|1,1,1]=4 481 B9R1.67 CC(C)SC1CCC1=O 62a_100009892977_100000210206 [0,0,0,1,0,0|1,1,1]=4 482 B9R1.112 CC(=O)C(C)OC1CC1 34a_100000212229_100000211595 [0,0,0,1,0,0|1,0,1]=3 483 B9R1.112 CC(=O)C(C)SC1CC1 62a_100009814033_100000211595 [0,0,0,1,0,0|1,1,1]=4 484 B9R1.112 C[C@@H](OC1CC1)C(=O)N 34a_100000731257_100000211595 [0,0,0,1,0,0|2,0,1]=4 485 B9R1.137 CC(=O)NC(C)C1CC1 11a_100000700016_100015343762 [0,0,0,1,0,0|2,0,1]=4 486 B9R1.137 CC(=O)NC(C)C1CC1 1626a_100000700016_100015343762 [0,0,0,1,0,0|2,0,1]=4 487 B9R1.137 CC(=O)NC(C)C1CC1 240690a_100000700016_100015343762 [0,0,0,1,0,0|2,0,1]=4 488 B9R1.137 CC(=O)NC(C)C1CC1 527a_100000700016_100103153847 [0,0,0,1,0,0|2,0,1]=4 489 B9R1.164 CC(=O)C1CC(C1)(C)C 1458a_100000695498_200000210301 [0,0,0,1,0,0|2,0,1]=4 490 B9R1.164 CC(=O)[C@H]1C[C@@](C1)(C)O 1458a_100010742821_200000210301 [0,0,0,1,0,0|1,0,2]=4 491 B9R1.164 CC1(CC(C1)C(=O)[13CH3])C 1458a_100000695498_200025704644 [0,0,0,1,0,0|2,0,1]=4 492 B9R1.164 C[C@@]1(C[C@H](C1)C(=O)[13CH3])O 1458a_100010742821_200025704644 [0,0,0,1,0,0|1,0,2]=4 493 B7R0.16 CC(=O)C(C)C(=O)C 1458a_100000070787_100000179758 [0,0,0,0,1,0|0,0,0]=1 494 B7R0.16 CC(=O)C(C)C(=O)N 1458a_100000070787_100000702099 [0,0,0,0,1,0|1,0,0]=2 495 B7R0.16 CC(=O)C(C)C(C)C 1458a_100000755409_200000210301 [0,0,0,0,1,0|1,0,1]=3 496 B7R0.16 CC(=O)C(C)N(C)C 2230a_100102631434_100009814033 [0,0,0,0,1,0|2,0,0]=3 497 B7R0.16 CC(=O)C(C)N(C)C 269982a_100102631434_100009814033 [0,0,0,0,1,0|2,0,0]=3 498 B7R0.16 CC(=O)C(F)C(=O)N 1458a_100000070787_100009813875 [0,0,0,0,1,0|2,0,0]=3 499 B7R0.16 CC(=O)C(F)C(=O)[O-] 1458a_100000070787_100020610796 [0,0,0,0,1,0|2,0,0]=3 500 B7R0.16 CC(=O)N(C)C(C)C 11a_200000211004_100015343762 [0,0,0,0,1,0|2,0,1]=4 501 B7R0.16 CC(=O)N(C)C(C)C 1626a_200000211004_100015343762 [0,0,0,0,1,0|2,0,1]=4 502 B7R0.16 CC(=O)N(C)C(C)C 240690a_200000211004_100015343762 [0,0,0,0,1,0|2,0,1]=4 503 B7R0.16 CC(=O)N(C)C(C)C 527a_200000211004_100103153847 [0,0,0,0,1,0|2,0,1]=4 504 B7R0.16 CC(=O)[C@H](C)N(C)C 1458a_100009822176_200000210301 [0,0,0,0,1,0|2,0,0]=3 505 B7R0.16 CC(=O)[C@H](O)C(C)C 1458a_100000691806_200000210301 [0,0,0,0,1,0|2,0,1]=4 506 B7R0.16 CC(C(=O)N)N(C)C 2230a_100102631434_100000702099 [0,0,0,0,1,0|3,0,0]=4 507 B7R0.16 CC(C(=O)N)N(C)C 269982a_100102631434_100000184083 [0,0,0,0,1,0|3,0,0]=4 508 B7R0.16 CC(C(=O)O)N(C)C 269956a_100000749554_200000210301 [0,0,0,0,1,0|3,0,0]=4 509 B7R0.16 CC(C(=O)O)N(C)[13CH3] 269956a_100000749554_200025704644 [0,0,0,0,1,0|3,0,0]=4 510 B7R0.16 CC(C)C(C)C(=O)[13CH3] 1458a_100000755409_200025704644 [0,0,0,0,1,0|1,0,1]=3 511 B7R0.16 CC(C)[C@@H](O)C(=O)[13CH3] 1458a_100000691806_200025704644 [0,0,0,0,1,0|2,0,1]=4 512 B7R0.16 C[C@@H](C(=O)[13CH3])N(C)C 1458a_100009822176_200025704644 [0,0,0,0,1,0|2,0,0]=3 513 B9R0.7 C=C(C)C(=NNC(=O)C)C 4a_100000189765_100011216138 [0,0,0,0,0,1|2,0,1]=4 514 B9R0.7 C=C(C)CN[C@@H](C)C(=O)O 269956a_100000743915_100000748629 [0,0,0,0,0,1|3,0,0]=4 515 B9R0.7 C=C(C)CN[C@H](C)C(=O)N 2230a_100000119354_100000748629 [0,0,0,0,0,1|3,0,0]=4 516 B9R0.7 C=C(C)CN[C@H](C)C(=O)N 34a_100000119354_100000748629 [0,0,0,0,0,1|3,0,0]=4 517 B9R0.7 C=C(C)COC(C)C(=O)C 34a_100000212229_100000748629 [0,0,0,0,0,1|1,0,0]=2 518 B9R0.7 C=C(C)COC(C)C(=O)N 34a_100000210245_100000702099 [0,0,0,0,0,1|2,0,0]=3 519 B9R0.7 C=C(C)COC(C)C(C)C 7a_100000748068_100000748629 [0,0,0,0,0,1|2,0,1]=4 520 B9R0.7 C=C(C)COC(F)C(=O)N 34a_100000210245_100009813875 [0,0,0,0,0,1|3,0,0]=4 521 B9R0.7 C=C(C)COC(F)C(=O)[O-] 34a_100000210245_100020610796 [0,0,0,0,0,1|3,0,0]=4 522 B9R0.7 C=C(C)CO[C@@H](C)C(=O)[O-] 7a_217856618621_100000748629 [0,0,0,0,0,1|2,0,0]=3 523 B9R0.7 C=C(C)CO[C@H](C)C(=O)N 34a_100000731257_100000748629 [0,0,0,0,0,1|2,0,0]=3 524 B9R0.7 C=C(C)CO[C@H](C)C(=O)N 7a_100000731257_100000748629 [0,0,0,0,0,1|2,0,0]=3 525 B9R0.7 C=C(C)CSC(C)C(=O)C 62a_100000748629_100009814033 [0,0,0,0,0,1|1,1,0]=3 526 B9R0.7 C=C(C)CSC(C)C(=O)C 62a_100009814033_100000211660 [0,0,0,0,0,1|1,1,0]=3 527 B9R0.7 C=C(C)CSC(C)C(=O)N 62a_100000702099_100000211660 [0,0,0,0,0,1|2,1,0]=4 528 B9R0.7 C=C(C)CSC(C)C(=O)N 62a_100000748629_100000702099 [0,0,0,0,0,1|2,1,0]=4 529 B9R0.7 C=C(F)COC(C)C(=O)C 34a_100000212229_100009893438 [0,0,0,0,0,1|1,0,1]=3 530 B9R0.7 C=C(F)COC(C)C(=O)N 34a_200010262243_100000702099 [0,0,0,0,0,1|2,0,1]=4 531 B9R0.7 C=C(F)CO[C@@H](C)C(=O)[O-] 7a_217856618621_100000042424 [0,0,0,0,0,1|2,0,1]=4 532 B9R0.7 C=C(F)CO[C@H](C)C(=O)N 34a_100000731257_100009893438 [0,0,0,0,0,1|2,0,1]=4 533 B9R0.7 C=C(F)CO[C@H](C)C(=O)N 7a_100000731257_100000042424 [0,0,0,0,0,1|2,0,1]=4 534 B9R0.7 C=C(F)CSC(C)C(=O)C 62a_100000042424_100009814033 [0,0,0,0,0,1|1,1,1]=4 535 B9R0.7 C=C(F)CSC(C)C(=O)C 62a_100009814033_100000042424 [0,0,0,0,0,1|1,1,1]=4 536 B9R0.7 CC(=O)C(C)CCC(C)C 1458a_100000070787_100011261404 [0,0,0,0,0,1|2,0,1]=4 537 B9R0.7 CC(=O)C(C)COC(C)C 34a_100000032740_100000210206 [0,0,0,0,0,1|1,0,1]=3 538 B9R0.7 CC(=O)C(C)COC(C)C 7a_100000032740_100000210206 [0,0,0,0,0,1|1,0,1]=3 539 B9R0.7 CC(=O)C(C)NCC(=O)N 2230a_100000711301_100009814033 [0,0,0,0,0,1|2,0,0]=3 540 B9R0.7 CC(=O)C(C)NCC(=O)O 269956a_100016091260_100009814033 [0,0,0,0,0,1|2,0,0]=3 541 B9R0.7 CC(=O)C(C)NCC(C)C 2230a_100000210953_100009814033 [0,0,0,0,0,1|2,0,1]=4 542 B9R0.7 CC(=O)C(C)NCC(C)O 2230a_100000210904_100009814033 [0,0,0,0,0,1|1,0,2]=4 543 B9R0.7 CC(=O)C(C)OCC(=O)N 34a_100000212229_100000187820 [0,0,0,0,0,1|1,0,0]=2 544 B9R0.7 CC(=O)C(C)OCC(=O)[O-] 34a_100000212229_100020667443 [0,0,0,0,0,1|1,0,0]=2 545 B9R0.7 CC(=O)C(C)OCC(C)C 34a_100000212229_100000210624 [0,0,0,0,0,1|1,0,1]=3 546 B9R0.7 CC(=O)C(C)OCC(C)O 34a_100000212229_100011218427 [0,0,0,0,0,1|0,0,2]=3 547 B9R0.7 CC(=O)C(C)OCC(F)F 34a_100000212229_100011934356 [0,0,0,0,0,1|2,0,1]=4 548 B9R0.7 CC(=O)C(C)OC[C@@H](C)O 34a_100000212229_100009817552 [0,0,0,0,0,1|0,0,2]=3 549 B9R0.7 CC(=O)C(C)OC[N+](=O)[O-] 34a_100000212229_100000761209 [0,0,0,0,0,1|2,0,0]=3 550 B9R0.7 CC(=O)C(C)SCC(=O)N 62a_100000747473_100009814033 [0,0,0,0,0,1|1,1,0]=3 551 B9R0.7 CC(=O)C(C)SCC(=O)N 62a_100009814033_100000747473 [0,0,0,0,0,1|1,1,0]=3 552 B9R0.7 CC(=O)C(C)SCC(=O)[O-] 62a_100009814033_100020667443 [0,0,0,0,0,1|1,1,0]=3 553 B9R0.7 CC(=O)C(C)SCC(=O)[O-] 62a_100020667443_100009814033 [0,0,0,0,0,1|1,1,0]=3 554 B9R0.7 CC(=O)C(C)SCC(C)C 62a_100000210624_100009814033 [0,0,0,0,0,1|1,1,1]=4 555 B9R0.7 CC(=O)C(C)SCC(C)C 62a_100009814033_100000210760 [0,0,0,0,0,1|1,1,1]=4 556 B9R0.7 CC(=O)C(C)SCC(C)O 62a_100009814033_100011218427 [0,0,0,0,0,1|0,1,2]=4 557 B9R0.7 CC(=O)C(C)SCC(C)O 62a_100011218427_100009814033 [0,0,0,0,0,1|0,1,2]=4 558 B9R0.7 CC(=O)C(C)SC[C@@H](C)O 62a_100009814033_100009817552 [0,0,0,0,0,1|0,1,2]=4 559 B9R0.7 CC(=O)C(C)SC[C@@H](C)O 62a_100009817552_100009814033 [0,0,0,0,0,1|0,1,2]=4 560 B9R0.7 CC(=O)C(C)SC[N+](=O)[O-] 62a_100009814033_100000761209 [0,0,0,0,0,1|2,1,0]=4 561 B9R0.7 CC(=O)CCN(C)C(=O)C 1458a_100011216537_200000210301 [0,0,0,0,0,1|2,0,0]=3 562 B9R0.7 CC(=O)COC(C)C(=O)N 34a_100000211253_100000702099 [0,0,0,0,0,1|1,0,0]=2 563 B9R0.7 CC(=O)COC(F)C(=O)N 34a_100000211253_100009813875 [0,0,0,0,0,1|2,0,0]=3 564 B9R0.7 CC(=O)COC(F)C(=O)[O-] 34a_100000211253_100020610796 [0,0,0,0,0,1|2,0,0]=3 565 B9R0.7 CC(=O)N(C)CCC(=O)N 11a_100000730477_100015343762 [0,0,0,0,0,1|3,0,0]=4 566 B9R0.7 CC(=O)N(C)CCC(=O)N 240690a_100000730477_100015343762 [0,0,0,0,0,1|3,0,0]=4 567 B9R0.7 CC(=O)N(C)CCC(=O)N 527a_100000730477_100103153847 [0,0,0,0,0,1|3,0,0]=4 568 B9R0.7 CC(=O)N(C)CCC(=O)[13CH3] 1458a_100011216537_200025704644 [0,0,0,0,0,1|2,0,0]=3 569 B9R0.7 CC(=O)OCC(C)N(C)C 270004a_100102631434_100000000629 [0,0,0,0,0,1|2,0,0]=3 570 B9R0.7 CC(=O)OCN(C)C(C)C 269982a_200000211004_100000076356 [0,0,0,0,0,1|2,0,1]=4 571 B9R0.7 CC(=O)SC[C@@H](C)C(=O)C 1458a_200015407212_200000210301 [0,0,0,0,0,1|0,1,0]=2 572 B9R0.7 CC(=O)SC[C@@H](C)C(=O)[13CH3] 1458a_200015407212_200025704644 [0,0,0,0,0,1|0,1,0]=2 573 B9R0.7 CC(Br)COC(C)C(=O)N 34a_100012180447_100000702099 [0,0,0,0,0,1|2,0,1]=4 574 B9R0.7 CC(C)C(C)OCC(=O)N 7a_100000748068_100000187820 [0,0,0,0,0,1|2,0,1]=4 575 B9R0.7 CC(C)COC(C)C(=O)N 34a_100000210257_100000702099 [0,0,0,0,0,1|2,0,1]=4 576 B9R0.7 CC(C)CO[C@@H](C)C(=O)[O-] 7a_217856618621_100000210760 [0,0,0,0,0,1|2,0,1]=4 577 B9R0.7 CC(C)CO[C@H](C)C(=O)N 34a_100000731257_100000210624 [0,0,0,0,0,1|2,0,1]=4 578 B9R0.7 CC(C)CO[C@H](C)C(=O)N 7a_100000731257_100000210760 [0,0,0,0,0,1|2,0,1]=4 579 B9R0.7 CC(F)COC(C)C(=O)N 34a_100015925927_100000702099 [0,0,0,0,0,1|2,0,1]=4 580 B9R0.7 CC(NCC(=O)N)C(=O)N 2230a_100000711301_100000702099 [0,0,0,0,0,1|3,0,0]=4 581 B9R0.7 CC(O)CO[C@@H](C)C(=O)[O-] 7a_217856618621_100011218427 [0,0,0,0,0,1|1,0,2]=4 582 B9R0.7 CC(O)CO[C@H](C)C(=O)N 34a_100000731257_100011218427 [0,0,0,0,0,1|1,0,2]=4 583 B9R0.7 CC(O)CO[C@H](C)C(=O)N 7a_100000731257_100011218427 [0,0,0,0,0,1|1,0,2]=4 584 B9R0.7 CC(OC[C@@H](C)Cl)C(=O)N 34a_100016084084_100000702099 [0,0,0,0,0,1|2,0,1]=4 585 B9R0.7 CC(OC[C@@H](C)N)C(=O)N 34a_100000737577_100000702099 [0,0,0,0,0,1|2,0,1]=4 586 B9R0.7 CC(SCC(=O)N)C(=O)N 62a_100000702099_100000747473 [0,0,0,0,0,1|2,1,0]=4 587 B9R0.7 CC(SCC(=O)N)C(=O)N 62a_100000747473_100000702099 [0,0,0,0,0,1|2,1,0]=4 588 B9R0.7 CC(SCC(=O)[O-])C(=O)N 62a_100000702099_100020667443 [0,0,0,0,0,1|2,1,0]=4 589 B9R0.7 CC(SCC(=O)[O-])C(=O)N 62a_100020667443_100000702099 [0,0,0,0,0,1|2,1,0]=4 590 B9R0.7 C[C@@H](NCC(=O)N)C(=O)N 2230a_100000119354_100000747473 [0,0,0,0,0,1|3,0,0]=4 591 B9R0.7 C[C@@H](NCC(=O)N)C(=O)N 34a_100000119354_100000187820 [0,0,0,0,0,1|3,0,0]=4 592 B9R0.7 C[C@@H](NCC(=O)[O-])C(=O)N 34a_100000119354_100020667443 [0,0,0,0,0,1|3,0,0]=4 593 B9R0.7 C[C@@H](O)CO[C@H](C)C(=O)N 34a_100000731257_100009817552 [0,0,0,0,0,1|1,0,2]=4 594 B9R0.7 C[C@@H](O)CO[C@H](C)C(=O)N 7a_100000731257_100009817552 [0,0,0,0,0,1|1,0,2]=4 595 B9R0.7 C[C@@H](OCC(=O)N)C(=O)N 34a_100000731257_100000187820 [0,0,0,0,0,1|2,0,0]=3 596 B9R0.7 C[C@@H](OCC(=O)N)C(=O)N 7a_100000731257_100000187820 [0,0,0,0,0,1|2,0,0]=3 597 B9R0.7 C[C@@H](OCC(=O)[O-])C(=O)N 34a_100000731257_100020667443 [0,0,0,0,0,1|2,0,0]=3 598 B9R0.7 C[C@@H](OC[N+](=O)[O-])C(=O)N 34a_100000731257_100000761209 [0,0,0,0,0,1|3,0,0]=4 599 B9R0.7 C[C@H](NCC(=O)N)C(=O)O 269956a_100000743915_100000187820 [0,0,0,0,0,1|3,0,0]=4 600 B9R0.7 C[C@H](NCC(=O)[O-])C(=O)O 269956a_100000743915_100020667443 [0,0,0,0,0,1|3,0,0]=4 601 B9R0.7 C[C@H](OCC(=O)N)C(=O)[O-] 7a_217856618621_100000187820 [0,0,0,0,0,1|2,0,0]=3 602 B9R0.7 C[C@H](OC[C@@H](C)O)C(=O)[O-] 7a_217856618621_100009817552 [0,0,0,0,0,1|1,0,2]=4 603 B9R0.53 CC(=CC(C)OC(C)C)C 34a_100000717055_100000210206 [0,0,0,0,0,1|2,0,1]=4 604 B9R0.53 CC(=O)CC(=O)NC(=O)C 1458a_100000070787_100000183797 [0,0,0,0,0,1|2,0,1]=4 605 B9R0.53 CC(=O)NC(C)CC(C)C 11a_100000692259_100015343762 [0,0,0,0,0,1|2,0,1]=4 606 B9R0.53 CC(=O)NC(C)CC(C)C 1626a_100000692259_100015343762 [0,0,0,0,0,1|2,0,1]=4 607 B9R0.53 CC(=O)NC(C)CC(C)C 240690a_100000692259_100015343762 [0,0,0,0,0,1|2,0,1]=4 608 B9R0.53 CC(=O)NC(C)CC(C)C 527a_100000692259_100103153847 [0,0,0,0,0,1|2,0,1]=4 609 B9R0.53 CC(=O)NC(C)CN(C)C 11a_100016992788_100015343762 [0,0,0,0,0,1|3,0,0]=4 610 B9R0.53 CC(=O)NC(C)CN(C)C 240690a_100016992788_100015343762 [0,0,0,0,0,1|3,0,0]=4 611 B9R0.53 CC(=O)NC(C)CN(C)C 527a_100016992788_100103153847 [0,0,0,0,0,1|3,0,0]=4 612 B9R0.53 CC(=O)OC(C)SC(C)C 62a_100000210206_100009818208 [0,0,0,0,0,1|1,0,1]=3 613 B9R0.53 CC(=O)OC(C)SC(C)C 62a_100009818208_100000210206 [0,0,0,0,0,1|1,0,1]=3 614 B6R0.1 C/C=C/C(C)OC 34a_200102604097_200000210301 [2,0,0,0,0,0|2,0,0]=4 615 B6R0.1 C/C=C/C(C)O[13CH3] 34a_200102604097_200025704644 [2,0,0,0,0,0|2,0,0]=4 616 B6R0.1 C=CC(C)OCC 34a_100000695699_100000210202 [2,0,0,0,0,0|0,0,2]=4 617 B6R0.1 CCOC(C)CC 34a_100121572206_100011215416 [2,0,0,0,0,0|0,0,2]=4 618 B6R0.1 CCOC(C)CC 7a_100000210228_100000210202 [2,0,0,0,0,0|0,0,2]=4 619 B6R0.2 C=C(C)CC(=O)C 1458a_100000070787_100000748629 [2,0,0,0,0,0|1,0,1]=4 620 B6R0.2 CC(=CC(=O)[13CH3])C 1458a_100000211388_200025704644 [2,0,0,0,0,0|1,0,1]=4 621 B6R0.2 CC(=O)C=C(C)C 1458a_100000211388_200000210301 [2,0,0,0,0,0|1,0,1]=4 622 B6R0.2 CC(=O)CC(C)C 1458a_100000070787_100000210624 [2,0,0,0,0,0|1,0,0]=3 623 B6R0.2 CC(=O)CC(C)C 1458a_100000210554_200000210301 [2,0,0,0,0,0|1,0,0]=3 624 B6R0.2 CC(=O)CC(C)O 1458a_100000070787_100011218427 [2,0,0,0,0,0|1,0,1]=4 625 B6R0.2 CC(=O)CN(C)C 1458a_100000750896_200000210301 [2,0,0,0,0,0|2,0,0]=4 626 B6R0.2 CC(=O)C[C@@H](C)O 1458a_100011933948_200000210301 [2,0,0,0,0,0|1,0,1]=4 627 B6R0.2 CC(=O)C[S+](C)C 1458a_200159257847_200000210301 [2,0,0,0,0,0|2,0,0]=4 628 B6R0.2 CC(=O)NC(C)C 11a_100138425928_100015343762 [2,0,0,0,0,0|1,0,0]=3 629 B6R0.2 CC(=O)NC(C)C 1626a_100138425928_100015343762 [2,0,0,0,0,0|1,0,0]=3 630 B6R0.2 CC(=O)NC(C)C 240690a_100138425928_100015343762 [2,0,0,0,0,0|1,0,0]=3 631 B6R0.2 CC(=O)NC(C)C 527a_100138425928_100103153847 [2,0,0,0,0,0|1,0,0]=3 632 B6R0.2 CC(C)CC(=O)[13CH3] 1458a_100000210554_200025704644 [2,0,0,0,0,0|1,0,0]=3 633 B6R0.2 CC(C)OC(C)C 34a_100000212225_100000210206 [2,0,0,0,0,0|1,0,1]=4 634 B6R0.2 CN(C)CC(=O)[13CH3] 1458a_100000750896_200025704644 [2,0,0,0,0,0|2,0,0]=4 635 B6R0.2 C[C@@H](O)CC(=O)[13CH3] 1458a_100011933948_200025704644 [2,0,0,0,0,0|1,0,1]=4 636 B6R0.2 C[S+](C)CC(=O)[13CH3] 1458a_200159257847_200025704644 [2,0,0,0,0,0|2,0,0]=4 637 B6R0.4 C/C=C/CC(=O)C 1458a_100000070787_100102629194 [2,0,0,0,0,0|1,0,0]=3 638 B6R0.4 C=C(C)COCC 34a_100000210245_100000210202 [2,0,0,0,0,0|1,0,1]=4 639 B6R0.4 C=C(C)COCC 34a_100121572206_100000748629 [2,0,0,0,0,0|1,0,1]=4 640 B6R0.4 C=CCCC(=O)C 1458a_100000070787_100000754431 [2,0,0,0,0,0|1,0,1]=4 641 B6R0.4 C=CCCC(=O)C 1458a_100000749702_200000210301 [2,0,0,0,0,0|1,0,1]=4 642 B6R0.4 C=CCCC(=O)[13CH3] 1458a_100000749702_200025704644 [2,0,0,0,0,0|1,0,1]=4 643 B6R0.4 C=CCNC(=O)C 1626a_100020586998_100015343762 [2,0,0,0,0,0|1,0,1]=4 644 B6R0.4 C=CCNC(=O)C 240690a_100020586998_100015343762 [2,0,0,0,0,0|1,0,1]=4 645 B6R0.4 C=CCNC(=O)C 527a_100020586998_100103153847 [2,0,0,0,0,0|1,0,1]=4 646 B6R0.4 CC#CCC(=O)C 1458a_100000070787_100000748600 [2,0,0,0,0,0|1,0,1]=4 647 B6R0.4 CC(=O)CCO[13CH3] 34a_100000759926_200025704644 [2,0,0,0,0,0|2,0,0]=4 648 B6R0.4 CC(=O)CCO[13CH3] 7a_100000759926_200025704644 [2,0,0,0,0,0|2,0,0]=4 649 B6R0.4 CC(=O)CCS[13CH3] 62a_100000053229_200025704644 [2,0,0,0,0,0|2,0,0]=4 650 B6R0.4 CC(=O)CCS[13CH3] 62a_200025704644_100000053229 [2,0,0,0,0,0|2,0,0]=4 651 B6R0.4 CC(=O)COCF 34a_100000211253_100015361967 [2,0,0,0,0,0|1,0,1]=4 652 B6R0.4 CC(=O)OCS[13CH3] 62a_100000076356_200025704644 [2,0,0,0,0,0|1,0,0]=3 653 B6R0.4 CC(=O)OCS[13CH3] 62a_200025704644_100000076356 [2,0,0,0,0,0|1,0,0]=3 654 B6R0.4 CC(C)OCC=O 34a_100000212225_200009817547 [2,0,0,0,0,0|1,0,1]=4 655 B6R0.4 CC=CCC(=O)C 1458a_100000070787_100000070051 [2,0,0,0,0,0|1,0,0]=3 656 B6R0.4 CC=CCC(=O)C 1458a_100121576822_200000210301 [2,0,0,0,0,0|1,0,0]=3 657 B6R0.4 CC=CCC(=O)[13CH3] 1458a_100121576822_200025704644 [2,0,0,0,0,0|1,0,0]=3 658 B6R0.4 CC=NNC(=O)C 4a_100000189765_200000210099 [2,0,0,0,0,0|2,0,0]=4 659 B6R0.4 CCCCC(=O)C 1458a_100000070787_100000210211 [2,0,0,0,0,0|1,0,1]=4 660 B6R0.4 CCCCC(=O)C 1458a_100000210183_200000210301 [2,0,0,0,0,0|1,0,1]=4 661 B6R0.4 CCCCC(=O)[13CH3] 1458a_100000210183_200025704644 [2,0,0,0,0,0|1,0,1]=4 662 B6R0.4 CCCNC(=O)C 11a_100020643023_100015343762 [2,0,0,0,0,0|1,0,1]=4 663 B6R0.4 CCCNC(=O)C 1626a_100020643023_100015343762 [2,0,0,0,0,0|1,0,1]=4 664 B6R0.4 CCCNC(=O)C 240690a_100020643023_100015343762 [2,0,0,0,0,0|1,0,1]=4 665 B6R0.4 CCCNC(=O)C 527a_100020643023_100103153847 [2,0,0,0,0,0|1,0,1]=4 666 B6R0.4 CCOCC(=O)C 1458a_100000211967_200000210301 [2,0,0,0,0,0|0,0,1]=3 667 B6R0.4 CCOCC(=O)C 34a_100000211253_100000210202 [2,0,0,0,0,0|0,0,1]=3 668 B6R0.4 CCOCC(=O)N 34a_100121572206_100000187820 [2,0,0,0,0,0|1,0,1]=4 669 B6R0.4 CCOCC(=O)[13CH3] 1458a_100000211967_200025704644 [2,0,0,0,0,0|0,0,1]=3 670 B6R0.4 CCOCC(=O)[O-] 34a_100121572206_100020667443 [2,0,0,0,0,0|1,0,1]=4 671 B6R0.4 CCSCC(=O)C 1458a_100000230394_200000210301 [2,0,0,0,0,0|0,1,1]=4 672 B6R0.4 CCSCC(=O)[13CH3] 1458a_100000230394_200025704644 [2,0,0,0,0,0|0,1,1]=4 673 B6R0.4 CNCCC(=O)C 7a_106832991635_100000053229 [2,0,0,0,0,0|2,0,0]=4 674 B6R0.4 CNCOC(=O)C 34a_100102657272_100009813279 [2,0,0,0,0,0|1,0,0]=3 675 B6R0.4 CNOCC(=O)O 269956a_100000106656_200000210301 [2,0,0,0,0,0|2,0,0]=4 676 B6R0.4 COCCC(=O)C 1458a_100000070787_100000233755 [2,0,0,0,0,0|2,0,0]=4 677 B6R0.4 COCCC(=O)C 1458a_100000749529_200000210301 [2,0,0,0,0,0|2,0,0]=4 678 B6R0.4 COCCC(=O)C 34a_100000759926_200000210301 [2,0,0,0,0,0|2,0,0]=4 679 B6R0.4 COCCC(=O)C 7a_100000759926_200000210301 [2,0,0,0,0,0|2,0,0]=4 680 B6R0.4 COCCC(=O)[13CH3] 1458a_100000749529_200025704644 [2,0,0,0,0,0|2,0,0]=4 681 B6R0.4 COCOC(=O)C 34a_100138415774_100009813279 [2,0,0,0,0,0|1,0,0]=3 682 B6R0.4 CSCCC(=O)C 1458a_100000070787_100000751147 [2,0,0,0,0,0|2,0,0]=4 683 B6R0.4 CSCCC(=O)C 1458a_100000174002_200000210301 [2,0,0,0,0,0|2,0,0]=4 684 B6R0.4 CSCCC(=O)C 62a_100000053229_200000210301 [2,0,0,0,0,0|2,0,0]=4 685 B6R0.4 CSCCC(=O)C 62a_200000210301_100000053229 [2,0,0,0,0,0|2,0,0]=4 686 B6R0.4 CSCCC(=O)[13CH3] 1458a_100000174002_200025704644 [2,0,0,0,0,0|2,0,0]=4 687 B6R0.4 CSCOC(=O)C 62a_100000076356_200000210301 [2,0,0,0,0,0|1,0,0]=3 688 B6R0.4 CSCOC(=O)C 62a_200000210301_100000076356 [2,0,0,0,0,0|1,0,0]=3 689 B6R0.4 [13CH3]NOCC(=O)O 269956a_100000106656_200025704644 [2,0,0,0,0,0|2,0,0]=4 690 B6R0.3 C#CC(C)C(=O)C 1458a_100000070787_200000035995 [2,0,0,0,0,0|0,0,2]=4 691 B6R0.3 C/C=C(\C)/C(=O)C 1458a_100020587367_200000210301 [2,0,0,0,0,0|0,0,1]=3 692 B6R0.3 C/C=C(\C)/C(=O)[13CH3] 1458a_100020587367_200025704644 [2,0,0,0,0,0|0,0,1]=3 693 B6R0.3 C=C(C)C(C)NC 269862a_106832991636_100011216138 [2,0,0,0,0,0|2,0,0]=4 694 B6R0.3 C=CC(C)C(=O)C 1458a_100011216780_200000210301 [2,0,0,0,0,0|0,0,1]=3 695 B6R0.3 C=CC(C)C(=O)[13CH3] 1458a_100011216780_200025704644 [2,0,0,0,0,0|0,0,1]=3 696 B6R0.3 CC(=O)C(C)C#N 1458a_100000070787_100000703298 [2,0,0,0,0,0|1,0,1]=4 697 B6R0.3 CC(=O)C(C)C#N 1458a_100000753662_200000210301 [2,0,0,0,0,0|1,0,1]=4 698 B6R0.3 CC(=O)C(C)O[13CH3] 34a_100000212229_200025704644 [2,0,0,0,0,0|0,0,0]=2 699 B6R0.3 CC(=O)C(C)S[13CH3] 62a_100009814033_200025704644 [2,0,0,0,0,0|0,1,0]=3 700 B6R0.3 CC(=O)C(C)S[13CH3] 62a_200025704644_100009814033 [2,0,0,0,0,0|0,1,0]=3 701 B6R0.3 CC(C#N)C(=O)[13CH3] 1458a_100000753662_200025704644 [2,0,0,0,0,0|1,0,1]=4 702 B6R0.3 CC(C)C(C)O[13CH3] 7a_100000748068_200025704644 [2,0,0,0,0,0|1,0,1]=4 703 B6R0.3 CC(S[13CH3])C(=O)N 62a_100000702099_200025704644 [2,0,0,0,0,0|1,1,0]=4 704 B6R0.3 CC(S[13CH3])C(=O)N 62a_200025704644_100000702099 [2,0,0,0,0,0|1,1,0]=4 705 B6R0.3 CCC(C)C(=O)C 1458a_100000070787_100000758301 [2,0,0,0,0,0|0,0,1]=3 706 B6R0.3 CCC(C)C(=O)C 1458a_100011192722_200000210301 [2,0,0,0,0,0|0,0,1]=3 707 B6R0.3 CCC(C)C(=O)[13CH3] 1458a_100011192722_200025704644 [2,0,0,0,0,0|0,0,1]=3 708 B6R0.3 CCC(O)C(=O)C 1458a_100011196387_200000210301 [2,0,0,0,0,0|1,0,1]=4 709 B6R0.3 CCC(O)C(=O)[13CH3] 1458a_100011196387_200025704644 [2,0,0,0,0,0|1,0,1]=4 710 B6R0.3 CCN(C)C(=O)C 11a_100000225621_100015343762 [2,0,0,0,0,0|1,0,1]=4 711 B6R0.3 CCN(C)C(=O)C 1626a_100000225621_100015343762 [2,0,0,0,0,0|1,0,1]=4 712 B6R0.3 CCN(C)C(=O)C 240690a_100000225621_100015343762 [2,0,0,0,0,0|1,0,1]=4 713 B6R0.3 CCN(C)C(=O)C 527a_100000225621_100103153847 [2,0,0,0,0,0|1,0,1]=4 714 B6R0.3 CNC(C)C(=O)C 2230a_106832991635_100009814033 [2,0,0,0,0,0|1,0,0]=3 715 B6R0.3 CNC(C)C(=O)C 7a_106832991635_100000179758 [2,0,0,0,0,0|1,0,0]=3 716 B6R0.3 CNC(C)C(=O)N 2230a_106832991635_100000702099 [2,0,0,0,0,0|2,0,0]=4 717 B6R0.3 CNC(C)C(=O)N 34a_100102657272_100000702099 [2,0,0,0,0,0|2,0,0]=4 718 B6R0.3 CNC(C)C(=O)N 7a_106832991635_100000702099 [2,0,0,0,0,0|2,0,0]=4 719 B6R0.3 CN[C@@H](C)C(=O)O 269956a_100000743915_200000210301 [2,0,0,0,0,0|2,0,0]=4 720 B6R0.3 CN[C@H](C)C(=O)N 2230a_100000119354_200000210301 [2,0,0,0,0,0|2,0,0]=4 721 B6R0.3 CN[C@H](C)C(=O)N 34a_100000119354_200000210301 [2,0,0,0,0,0|2,0,0]=4 722 B6R0.3 COC(C)C(=O)C 1458a_100000743197_200000210301 [2,0,0,0,0,0|0,0,0]=2 723 B6R0.3 COC(C)C(=O)C 34a_100000212229_200000210301 [2,0,0,0,0,0|0,0,0]=2 724 B6R0.3 COC(C)C(=O)N 34a_100138415774_100000702099 [2,0,0,0,0,0|1,0,0]=3 725 B6R0.3 COC(C)C(=O)[13CH3] 1458a_100000743197_200025704644 [2,0,0,0,0,0|0,0,0]=2 726 B6R0.3 COC(C)C(C)C 7a_100000748068_200000210301 [2,0,0,0,0,0|1,0,1]=4 727 B6R0.3 COC(C)N(C)C 269982a_100102631434_100009879195 [2,0,0,0,0,0|2,0,0]=4 728 B6R0.3 COC(F)C(=O)N 34a_100138415774_100009813875 [2,0,0,0,0,0|2,0,0]=4 729 B6R0.3 COC(F)C(=O)[O-] 34a_100138415774_100020610796 [2,0,0,0,0,0|2,0,0]=4 730 B6R0.3 CO[C@@H](C)C(=O)[O-] 7a_217856618621_200000210301 [2,0,0,0,0,0|1,0,0]=3 731 B6R0.3 CO[C@H](C)C(=O)N 34a_100000731257_200000210301 [2,0,0,0,0,0|1,0,0]=3 732 B6R0.3 CO[C@H](C)C(=O)N 7a_100000731257_200000210301 [2,0,0,0,0,0|1,0,0]=3 733 B6R0.3 CSC(C)C(=O)C 1458a_100000149566_200000210301 [2,0,0,0,0,0|0,1,0]=3 734 B6R0.3 CSC(C)C(=O)C 62a_100009814033_200000210301 [2,0,0,0,0,0|0,1,0]=3 735 B6R0.3 CSC(C)C(=O)C 62a_200000210301_100009814033 [2,0,0,0,0,0|0,1,0]=3 736 B6R0.3 CSC(C)C(=O)N 62a_100000702099_200000210301 [2,0,0,0,0,0|1,1,0]=4 737 B6R0.3 CSC(C)C(=O)N 62a_200000210301_100000702099 [2,0,0,0,0,0|1,1,0]=4 738 B6R0.3 CSC(C)C(=O)[13CH3] 1458a_100000149566_200025704644 [2,0,0,0,0,0|0,1,0]=3 739 B6R0.3 C[C@@H](N[13CH3])C(=O)N 2230a_100000119354_200025704644 [2,0,0,0,0,0|2,0,0]=4 740 B6R0.3 C[C@@H](N[13CH3])C(=O)N 34a_100000119354_200025704644 [2,0,0,0,0,0|2,0,0]=4 741 B6R0.3 C[C@@H](O[13CH3])C(=O)N 34a_100000731257_200025704644 [2,0,0,0,0,0|1,0,0]=3 742 B6R0.3 C[C@@H](O[13CH3])C(=O)N 7a_100000731257_200025704644 [2,0,0,0,0,0|1,0,0]=3 743 B6R0.3 C[C@H](N[13CH3])C(=O)O 269956a_100000743915_200025704644 [2,0,0,0,0,0|2,0,0]=4 744 B6R0.3 C[C@H](O[13CH3])C(=O)[O-] 7a_217856618621_200025704644 [2,0,0,0,0,0|1,0,0]=3 745 B8R0.2 CCC(C)N(C)C(=O)C 11a_100000741768_100015343762 [1,1,0,0,0,0|1,0,1]=4 746 B8R0.2 CCC(C)N(C)C(=O)C 1626a_100000741768_100015343762 [1,1,0,0,0,0|1,0,1]=4 747 B8R0.2 CCC(C)N(C)C(=O)C 240690a_100000741768_100015343762 [1,1,0,0,0,0|1,0,1]=4 748 B8R0.2 CCC(C)N(C)C(=O)C 527a_100000741768_100103153847 [1,1,0,0,0,0|1,0,1]=4 749 B8R0.5 C/C=C/C(C)OC(C)C 34a_200102604097_100000210206 [1,1,0,0,0,0|1,0,1]=4 750 B8R0.5 CC(=O)N[C@H](C)CCO 240690a_100000706166_100015343762 [1,1,0,0,0,0|1,0,1]=4 751 B8R0.5 CC(=O)N[C@H](C)CCO 527a_100000706166_100103153847 [1,1,0,0,0,0|1,0,1]=4 752 B8R0.5 CC(=O)OC(C)SCF 62a_100009818208_100015361967 [1,1,0,0,0,0|1,0,0]=3 753 B8R0.5 CC(=O)OC(C)SCF 62a_100015361967_100009818208 [1,1,0,0,0,0|1,0,0]=3 754 B8R0.5 CCCC(C)CC(=O)C 1458a_100000070787_100011216630 [1,1,0,0,0,0|1,0,1]=4 755 B8R0.5 CCCC(C)CC(=O)C 1458a_100000748435_200000210301 [1,1,0,0,0,0|1,0,1]=4 756 B8R0.5 CCCC(C)CC(=O)[13CH3] 1458a_100000748435_200025704644 [1,1,0,0,0,0|1,0,1]=4 757 B8R0.5 CCCC(C)NC(=O)C 11a_100000741246_100015343762 [1,1,0,0,0,0|1,0,1]=4 758 B8R0.5 CCCC(C)NC(=O)C 1626a_100000741246_100015343762 [1,1,0,0,0,0|1,0,1]=4 759 B8R0.5 CCCC(C)NC(=O)C 240690a_100000741246_100015343762 [1,1,0,0,0,0|1,0,1]=4 760 B8R0.5 CCCC(C)NC(=O)C 527a_100000741246_100103153847 [1,1,0,0,0,0|1,0,1]=4 761 B8R0.5 CCSC(C)CC(=O)C 1458a_200011311441_200000210301 [1,1,0,0,0,0|1,0,1]=4 762 B8R0.5 CCSC(C)CC(=O)[13CH3] 1458a_200011311441_200025704644 [1,1,0,0,0,0|1,0,1]=4 763 B8R0.5 CCSC(C)OC(=O)C 62a_100000210202_100009818208 [1,1,0,0,0,0|0,0,1]=3 764 B8R0.5 CCSC(C)OC(=O)C 62a_100009818208_100000210202 [1,1,0,0,0,0|0,0,1]=3 765 B8R0.5 COC[C@@H](C)NC(=O)C 11a_100000764878_100015343762 [1,1,0,0,0,0|1,0,1]=4 766 B8R0.5 COC[C@@H](C)NC(=O)C 1626a_100000764878_100015343762 [1,1,0,0,0,0|1,0,1]=4 767 B8R0.5 COC[C@@H](C)NC(=O)C 240690a_100000764878_100015343762 [1,1,0,0,0,0|1,0,1]=4 768 B8R0.5 COC[C@@H](C)NC(=O)C 527a_100000764878_100103153847 [1,1,0,0,0,0|1,0,1]=4 769 B8R0.16 C=C[C@@H](CO)NC(=O)C 240690a_100016989147_100015343762 [1,1,0,0,0,0|1,0,1]=4 770 B8R0.16 C=C[C@@H](CO)NC(=O)C 527a_100016989147_100103153847 [1,1,0,0,0,0|1,0,1]=4 771 B8R0.16 CCC(CC)CC(=O)C 1458a_100000070787_100011215472 [1,1,0,0,0,0|1,0,1]=4 772 B8R0.16 CCC(CC)NC(=O)C 11a_100000199018_100015343762 [1,1,0,0,0,0|1,0,1]=4 773 B8R0.16 CCC(CC)NC(=O)C 1626a_100000199018_100015343762 [1,1,0,0,0,0|1,0,1]=4 774 B8R0.16 CCC(CC)NC(=O)C 240690a_100000199018_100015343762 [1,1,0,0,0,0|1,0,1]=4 775 B8R0.16 CCC(CC)NC(=O)C 527a_100000199018_100103153847 [1,1,0,0,0,0|1,0,1]=4 776 B8R0.16 CC[C@@H](CO)NC(=O)C 240690a_100000709445_100015343762 [1,1,0,0,0,0|1,0,1]=4 777 B8R0.16 CC[C@@H](CO)NC(=O)C 527a_100000709445_100103153847 [1,1,0,0,0,0|1,0,1]=4 778 B8R0.16 COC(CC(=O)C)OC 1458a_100000070787_100000751394 [1,1,0,0,0,0|2,0,0]=4 779 B8R0.16 COC(CC(=O)C)OC 1458a_100000082724_200000210301 [1,1,0,0,0,0|2,0,0]=4 780 B8R0.16 COC(CC(=O)[13CH3])OC 1458a_100000082724_200025704644 [1,1,0,0,0,0|2,0,0]=4 781 B8R0.19 C=CC(C)CC(=O)CC 1458a_100011934298_100000210202 [1,1,0,0,0,0|1,0,1]=4 782 B8R0.19 C=CC(C)CC(=O)CF 1458a_100011934298_100015361967 [1,1,0,0,0,0|1,0,1]=4 783 B8R0.19 C=CC(C)CC(=O)NC 11a_106832991635_100011934298 [1,1,0,0,0,0|1,0,1]=4 784 B8R0.19 C=CC(C)CC(=O)NC 1626a_100102657272_100011934298 [1,1,0,0,0,0|1,0,1]=4 785 B8R0.19 C=CC(C)CC(=O)NC 240690a_100102657272_100011934298 [1,1,0,0,0,0|1,0,1]=4 786 B8R0.19 C=CC(C)CC(=O)NC 527a_100102657272_100011934298 [1,1,0,0,0,0|1,0,1]=4 787 B8R0.19 CCC(=O)CC(C)CC 1458a_100000210414_100000748023 [1,1,0,0,0,0|1,0,1]=4 788 B8R0.19 CCC(=O)CC(C)CC 1458a_100000708755_100000210202 [1,1,0,0,0,0|1,0,1]=4 789 B8R0.19 CCC(=O)C[C@@H](C)CC 1458a_100000210414_100009816398 [1,1,0,0,0,0|1,0,1]=4 790 B8R0.19 CCC(=O)NC(C)CC 11a_100000209981_100000210414 [1,1,0,0,0,0|1,0,1]=4 791 B8R0.19 CCC(=O)NC(C)CC 1626a_100000209981_100000210414 [1,1,0,0,0,0|1,0,1]=4 792 B8R0.19 CCC(=O)NC(C)CC 240690a_100000209981_100000210414 [1,1,0,0,0,0|1,0,1]=4 793 B8R0.19 CCC(=O)NC(C)CC 527a_100000209981_100000210414 [1,1,0,0,0,0|1,0,1]=4 794 B8R0.19 CCC(C)CC(=O)CF 1458a_100000708755_100015361967 [1,1,0,0,0,0|1,0,1]=4 795 B8R0.19 CCC(C)CC(=O)CO 1458a_100000210174_100000748023 [1,1,0,0,0,0|1,0,1]=4 796 B8R0.19 CCC(C)CC(=O)NC 11a_106832991635_100000708755 [1,1,0,0,0,0|1,0,1]=4 797 B8R0.19 CCC(C)CC(=O)NC 1626a_100102657272_100000708755 [1,1,0,0,0,0|1,0,1]=4 798 B8R0.19 CCC(C)CC(=O)NC 240690a_100102657272_100000708755 [1,1,0,0,0,0|1,0,1]=4 799 B8R0.19 CCC(C)CC(=O)NC 527a_100102657272_100000708755 [1,1,0,0,0,0|1,0,1]=4 800 B8R0.19 CCC(C)NC(=O)CO 240690a_100000209981_100000210174 [1,1,0,0,0,0|1,0,1]=4 801 B8R0.19 CCC(C)NC(=O)CO 527a_100000209981_100000210174 [1,1,0,0,0,0|1,0,1]=4 802 B8R0.19 CCC(C)NC(=O)NC 2708a_100000209981_106832991635 [1,1,0,0,0,0|1,0,1]=4 803 B8R0.19 CCC(C)NC(=O)NC 2708a_100102657272_100000209981 [1,1,0,0,0,0|1,0,1]=4 804 B8R0.19 CCC(C)NC(=O)NC 273464a_100000209981_100102657272 [1,1,0,0,0,0|1,0,1]=4 805 B8R0.19 CCC(C)NC(=O)NC 273464a_100102657272_100000209981 [1,1,0,0,0,0|1,0,1]=4 806 B8R0.19 CCC(C)NC(=O)NC 512a_100000209981_100102657272 [1,1,0,0,0,0|1,0,1]=4 807 B8R0.19 CCC(C)NC(=O)NC 512a_106832991638_100000209981 [1,1,0,0,0,0|1,0,1]=4 808 B8R0.19 CC[C@H](C)CC(=O)CO 1458a_100000210174_100009816398 [1,1,0,0,0,0|1,0,1]=4 809 B8R0.19 CNC(C)CC(=O)OC 2230a_106832991635_100009817358 [1,1,0,0,0,0|2,0,0]=4 810 B8R0.19 CNC(C)CC(=O)OC 34a_100102657272_100009817358 [1,1,0,0,0,0|2,0,0]=4 811 B8R0.19 CNC(C)CC(=O)OC 7a_106832991635_100009817358 [1,1,0,0,0,0|2,0,0]=4 812 B8R0.19 COC(=O)CC(C)OC 34a_100138415774_100009817358 [1,1,0,0,0,0|2,0,0]=4 813 B8R0.19 COC(=O)CC(C)SC 62a_100009817358_200000210301 [1,1,0,0,0,0|2,0,0]=4 814 B8R0.19 COC(=O)CC(C)SC 62a_200000210301_100009817358 [1,1,0,0,0,0|2,0,0]=4 815 B8R0.19 COC(=O)CC(C)S[13CH3] 62a_100009817358_200025704644 [1,1,0,0,0,0|2,0,0]=4 816 B8R0.19 COC(=O)CC(C)S[13CH3] 62a_200025704644_100009817358 [1,1,0,0,0,0|2,0,0]=4 817 B8R0.34 CC(=O)CC(C)(C)O[13CH3] 7a_100000210262_200025704644 [1,1,0,0,0,0|2,0,0]=4 818 B8R0.34 CCC(C)(C)CC(=O)C 1458a_200000763500_200000210301 [1,1,0,0,0,0|1,0,1]=4 819 B8R0.34 CCC(C)(C)CC(=O)[13CH3] 1458a_200000763500_200025704644 [1,1,0,0,0,0|1,0,1]=4 820 B8R0.34 CCC(C)(C)NC(=O)C 11a_100000211385_100015343762 [1,1,0,0,0,0|1,0,1]=4 821 B8R0.34 CCC(C)(C)NC(=O)C 1626a_100000211385_100015343762 [1,1,0,0,0,0|1,0,1]=4 822 B8R0.34 CCC(C)(C)NC(=O)C 240690a_100000211385_100015343762 [1,1,0,0,0,0|1,0,1]=4 823 B8R0.34 CCC(C)(C)NC(=O)C 527a_100000211385_100103153847 [1,1,0,0,0,0|1,0,1]=4 824 B8R0.34 CCC(C)(O)CC(=O)C 1458a_200011219800_200000210301 [1,1,0,0,0,0|1,0,1]=4 825 B8R0.34 CCC(C)(O)CC(=O)[13CH3] 1458a_200011219800_200025704644 [1,1,0,0,0,0|1,0,1]=4 826 B8R0.34 COC(C)(C)CC(=O)C 7a_100000210262_200000210301 [1,1,0,0,0,0|2,0,0]=4 827 B8R0.3 C=CCC(C)C(=O)CC 1458a_100011216819_100000210202 [1,1,0,0,0,0|1,0,1]=4 828 B8R0.3 C=CCC(C)C(=O)CF 1458a_100011216819_100015361967 [1,1,0,0,0,0|1,0,1]=4 829 B8R0.3 C=CCC(C)C(=O)NC 11a_106832991635_100011216819 [1,1,0,0,0,0|1,0,1]=4 830 B8R0.3 C=CCC(C)C(=O)NC 1626a_100102657272_100011216819 [1,1,0,0,0,0|1,0,1]=4 831 B8R0.3 C=CCC(C)C(=O)NC 240690a_100102657272_100011216819 [1,1,0,0,0,0|1,0,1]=4 832 B8R0.3 C=CCC(C)C(=O)NC 527a_100102657272_100011216819 [1,1,0,0,0,0|1,0,1]=4 833 B8R0.3 CCC(=O)C(C)COC 1458a_100000210414_100000765312 [1,1,0,0,0,0|2,0,0]=4 834 B8R0.3 CCC(=O)C(C)COC 1458a_100000751857_100000210202 [1,1,0,0,0,0|2,0,0]=4 835 B8R0.3 CCC(=O)C(C)CSC 1458a_100000753918_100000210202 [1,1,0,0,0,0|2,0,0]=4 836 B8R0.3 CCCC(C)C(=O)CC 1458a_100000210414_100000766640 [1,1,0,0,0,0|1,0,1]=4 837 B8R0.3 CCCC(C)C(=O)CC 1458a_100000210906_100000210202 [1,1,0,0,0,0|1,0,1]=4 838 B8R0.3 CCCC(C)C(=O)CF 1458a_100000210906_100015361967 [1,1,0,0,0,0|1,0,1]=4 839 B8R0.3 CCCC(C)C(=O)CO 1458a_100000210174_100000766640 [1,1,0,0,0,0|1,0,1]=4 840 B8R0.3 CCCC(C)C(=O)NC 11a_106832991635_100000210906 [1,1,0,0,0,0|1,0,1]=4 841 B8R0.3 CCCC(C)C(=O)NC 1626a_100102657272_100000210906 [1,1,0,0,0,0|1,0,1]=4 842 B8R0.3 CCCC(C)C(=O)NC 240690a_100102657272_100000210906 [1,1,0,0,0,0|1,0,1]=4 843 B8R0.3 CCCC(C)C(=O)NC 527a_100102657272_100000210906 [1,1,0,0,0,0|1,0,1]=4 844 B8R0.3 CCNC(C)C(=O)CC 2230a_100015525214_100000742827 [1,1,0,0,0,0|1,0,1]=4 845 B8R0.3 CCNC(C)C(=O)NC 2230a_100015525214_100000731044 [1,1,0,0,0,0|1,0,1]=4 846 B8R0.3 CCNC(C)C(=O)OC 2230a_100015525214_100000211248 [1,1,0,0,0,0|1,0,1]=4 847 B8R0.3 CCN[C@H](C)C(=O)NC 2230a_100000684985_100000210202 [1,1,0,0,0,0|1,0,1]=4 848 B8R0.3 CCN[C@H](C)C(=O)NC 34a_100000684985_100000210202 [1,1,0,0,0,0|1,0,1]=4 849 B8R0.3 CCOC(C)C(=O)CC 1458a_100000739345_100000210202 [1,1,0,0,0,0|0,0,1]=3 850 B8R0.3 CCOC(C)C(=O)CF 1458a_100000739345_100015361967 [1,1,0,0,0,0|0,0,1]=3 851 B8R0.3 CCOC(C)C(=O)NC 11a_106832991635_100000739345 [1,1,0,0,0,0|0,0,1]=3 852 B8R0.3 CCOC(C)C(=O)NC 1626a_100102657272_100000739345 [1,1,0,0,0,0|0,0,1]=3 853 B8R0.3 CCOC(C)C(=O)NC 240690a_100102657272_100000739345 [1,1,0,0,0,0|0,0,1]=3 854 B8R0.3 CCOC(C)C(=O)NC 34a_100121572206_100000731044 [1,1,0,0,0,0|0,0,1]=3 855 B8R0.3 CCOC(C)C(=O)NC 527a_100102657272_100000739345 [1,1,0,0,0,0|0,0,1]=3 856 B8R0.3 CCOC(C)C(=O)NN 34a_100000725659_100000210202 [1,1,0,0,0,0|1,0,1]=4 857 B8R0.3 CCOC(C)C(=O)OC 34a_100011215400_100000210202 [1,1,0,0,0,0|0,0,1]=3 858 B8R0.3 CCOC(C)C(=O)OC 34a_100121572206_100000211248 [1,1,0,0,0,0|0,0,1]=3 859 B8R0.3 CCOC(F)C(=O)NC 34a_100121572206_100009813575 [1,1,0,0,0,0|1,0,1]=4 860 B8R0.3 CCSC(C)C(=O)CC 1458a_100000230601_100000210202 [1,1,0,0,0,0|0,1,1]=4 861 B8R0.3 CCSC(C)C(=O)CC 62a_100000210202_100000742827 [1,1,0,0,0,0|0,1,1]=4 862 B8R0.3 CCSC(C)C(=O)CC 62a_100000742827_100000210202 [1,1,0,0,0,0|0,1,1]=4 863 B8R0.3 CCSC(C)C(=O)CF 1458a_100000230601_100015361967 [1,1,0,0,0,0|0,1,1]=4 864 B8R0.3 CCSC(C)C(=O)NC 11a_106832991635_100000230601 [1,1,0,0,0,0|0,1,1]=4 865 B8R0.3 CCSC(C)C(=O)NC 1626a_100102657272_100000230601 [1,1,0,0,0,0|0,1,1]=4 866 B8R0.3 CCSC(C)C(=O)NC 240690a_100102657272_100000230601 [1,1,0,0,0,0|0,1,1]=4 867 B8R0.3 CCSC(C)C(=O)NC 527a_100102657272_100000230601 [1,1,0,0,0,0|0,1,1]=4 868 B8R0.3 CCSC(C)C(=O)NC 62a_100000209862_100000210202 [1,1,0,0,0,0|0,1,1]=4 869 B8R0.3 CCSC(C)C(=O)NC 62a_100000210202_100000731044 [1,1,0,0,0,0|0,1,1]=4 870 B8R0.3 CCSC(C)C(=O)OC 62a_100000210202_100000211248 [1,1,0,0,0,0|0,1,1]=4 871 B8R0.3 CCSC(C)C(=O)OC 62a_100000211248_100000210202 [1,1,0,0,0,0|0,1,1]=4 872 B8R0.3 CNC(=O)C(C)CN[13CH3] 2230a_100015187722_200025704644 [1,1,0,0,0,0|2,0,0]=4 873 B8R0.3 CNC(=O)C(C)CN[13CH3] 34a_100015187722_200025704644 [1,1,0,0,0,0|2,0,0]=4 874 B8R0.3 CNC(=O)C(C)COC 11a_106832991635_100000751857 [1,1,0,0,0,0|2,0,0]=4 875 B8R0.3 CNC(=O)C(C)COC 1626a_100102657272_100000751857 [1,1,0,0,0,0|2,0,0]=4 876 B8R0.3 CNC(=O)C(C)COC 240690a_100102657272_100000751857 [1,1,0,0,0,0|2,0,0]=4 877 B8R0.3 CNC(=O)C(C)COC 527a_100102657272_100000751857 [1,1,0,0,0,0|2,0,0]=4 878 B8R0.3 CNC(=O)C(C)CSC 11a_106832991635_100000753918 [1,1,0,0,0,0|2,0,0]=4 879 B8R0.3 CNC(=O)C(C)CSC 1626a_100102657272_100000753918 [1,1,0,0,0,0|2,0,0]=4 880 B8R0.3 CNC(=O)C(C)CSC 240690a_100102657272_100000753918 [1,1,0,0,0,0|2,0,0]=4 881 B8R0.3 CNC(=O)C(C)CSC 527a_100102657272_100000753918 [1,1,0,0,0,0|2,0,0]=4 882 B8R0.3 CNCC(C)C(=O)NC 2230a_100015187722_200000210301 [1,1,0,0,0,0|2,0,0]=4 883 B8R0.3 CNCC(C)C(=O)NC 34a_100015187722_200000210301 [1,1,0,0,0,0|2,0,0]=4 884 B8R0.3 CNCC(C)C(=O)OC 34a_100102657272_100000698445 [1,1,0,0,0,0|2,0,0]=4 885 B8R0.3 COC(=O)C(C)CO[13CH3] 34a_100000749362_200025704644 [1,1,0,0,0,0|2,0,0]=4 886 B8R0.3 COC(=O)C(C)CO[13CH3] 7a_100000749362_200025704644 [1,1,0,0,0,0|2,0,0]=4 887 B8R0.3 COC(=O)C(C)CSC 62a_100000698445_200000210301 [1,1,0,0,0,0|2,0,0]=4 888 B8R0.3 COC(=O)C(C)CSC 62a_200000210301_100000698445 [1,1,0,0,0,0|2,0,0]=4 889 B8R0.3 COC(=O)C(C)CS[13CH3] 62a_100000698445_200025704644 [1,1,0,0,0,0|2,0,0]=4 890 B8R0.3 COC(=O)C(C)CS[13CH3] 62a_200025704644_100000698445 [1,1,0,0,0,0|2,0,0]=4 891 B8R0.3 COC(=O)C(C)OCF 34a_100011215400_100015361967 [1,1,0,0,0,0|1,0,1]=4 892 B8R0.3 COCC(C)C(=O)CF 1458a_100000751857_100015361967 [1,1,0,0,0,0|2,0,0]=4 893 B8R0.3 COCC(C)C(=O)CO 1458a_100000210174_100000765312 [1,1,0,0,0,0|2,0,0]=4 894 B8R0.3 COCC(C)C(=O)OC 34a_100000749362_200000210301 [1,1,0,0,0,0|2,0,0]=4 895 B8R0.3 COCC(C)C(=O)OC 34a_100138415774_100000698445 [1,1,0,0,0,0|2,0,0]=4 896 B8R0.3 COCC(C)C(=O)OC 7a_100000749362_200000210301 [1,1,0,0,0,0|2,0,0]=4 897 B8R0.3 CSCC(C)C(=O)CF 1458a_100000753918_100015361967 [1,1,0,0,0,0|2,0,0]=4 898 B8R0.8 C#CCOC(C)C(=O)C 34a_100000212229_100000184674 [1,1,0,0,0,0|0,0,2]=4 899 B8R0.8 C=CCNC(C)C(=O)C 2230a_100020586998_100009814033 [1,1,0,0,0,0|1,0,1]=4 900 B8R0.8 C=CCOC(C)C(=O)C 34a_100000212229_100015514636 [1,1,0,0,0,0|0,0,1]=3 901 B8R0.8 C=CCOC(C)C(=O)N 34a_200000210373_100000702099 [1,1,0,0,0,0|1,0,1]=4 902 B8R0.8 C=CCO[C@@H](C)C(=O)[O-] 7a_217856618621_100015514636 [1,1,0,0,0,0|1,0,1]=4 903 B8R0.8 C=CCO[C@H](C)C(=O)N 34a_100000731257_100015514636 [1,1,0,0,0,0|1,0,1]=4 904 B8R0.8 C=CCO[C@H](C)C(=O)N 7a_100000731257_100015514636 [1,1,0,0,0,0|1,0,1]=4 905 B8R0.8 C=CCSC(C)C(=O)C 1458a_100000230602_200000210301 [1,1,0,0,0,0|0,1,1]=4 906 B8R0.8 C=CCSC(C)C(=O)C 62a_100000210623_100009814033 [1,1,0,0,0,0|0,1,1]=4 907 B8R0.8 C=CCSC(C)C(=O)C 62a_100009814033_100000210623 [1,1,0,0,0,0|0,1,1]=4 908 B8R0.8 C=CCSC(C)C(=O)[13CH3] 1458a_100000230602_200025704644 [1,1,0,0,0,0|0,1,1]=4 909 B8R0.8 CC(=O)C(C)COCF 34a_100000032740_100015361967 [1,1,0,0,0,0|1,0,1]=4 910 B8R0.8 CC(=O)C(C)COCF 7a_100000032740_100015361967 [1,1,0,0,0,0|1,0,1]=4 911 B8R0.8 CC(=O)C(C)NCCO 2230a_100016997473_100009814033 [1,1,0,0,0,0|1,0,1]=4 912 B8R0.8 CC(=O)C(C)OCC=O 34a_100000212229_200009817547 [1,1,0,0,0,0|0,0,0]=2 913 B8R0.8 CC(=O)C(C)OCCF 34a_100000212229_100011217306 [1,1,0,0,0,0|0,0,1]=3 914 B8R0.8 CC(=O)C(C)OCCO 34a_100000212229_100000211926 [1,1,0,0,0,0|0,0,1]=3 915 B8R0.8 CC(=O)C(C)SCC=O 62a_100009814033_200015260668 [1,1,0,0,0,0|0,1,0]=3 916 B8R0.8 CC(=O)C(C)SCC=O 62a_200015260668_100009814033 [1,1,0,0,0,0|0,1,0]=3 917 B8R0.8 CC(=O)C(C)SCCF 62a_100009814033_100011217306 [1,1,0,0,0,0|0,1,1]=4 918 B8R0.8 CC(=O)C(C)SCCF 62a_100011217306_100009814033 [1,1,0,0,0,0|0,1,1]=4 919 B8R0.8 CC(=O)C(C)SCCO 62a_100000211926_100009814033 [1,1,0,0,0,0|0,1,1]=4 920 B8R0.8 CC(=O)C(C)SCCO 62a_100009814033_100000211926 [1,1,0,0,0,0|0,1,1]=4 921 B8R0.8 CC(C)C(C)OCC=O 7a_100000748068_200015260668 [1,1,0,0,0,0|1,0,1]=4 922 B8R0.8 CC(OCCBr)C(=O)N 34a_100000211926_100000702099 [1,1,0,0,0,0|1,0,1]=4 923 B8R0.8 CC(OCCN)C(=O)N 34a_100000210304_100000702099 [1,1,0,0,0,0|1,0,1]=4 924 B8R0.8 CC(SCC=O)C(=O)N 62a_100000702099_200015260668 [1,1,0,0,0,0|1,1,0]=4 925 B8R0.8 CC(SCC=O)C(=O)N 62a_200015260668_100000702099 [1,1,0,0,0,0|1,1,0]=4 926 B8R0.8 CCCCC(C)C(=O)C 1458a_100000070787_200011215066 [1,1,0,0,0,0|1,0,1]=4 927 B8R0.8 CCCCC(C)C(=O)C 1458a_100000725509_200000210301 [1,1,0,0,0,0|1,0,1]=4 928 B8R0.8 CCCCC(C)C(=O)[13CH3] 1458a_100000725509_200025704644 [1,1,0,0,0,0|1,0,1]=4 929 B8R0.8 CCCOC(C)C(=O)C 34a_100000212229_100000210303 [1,1,0,0,0,0|0,0,1]=3 930 B8R0.8 CCCOC(C)C(=O)N 34a_100000210258_100000702099 [1,1,0,0,0,0|1,0,1]=4 931 B8R0.8 CCCO[C@@H](C)C(=O)[O-] 7a_217856618621_100000210303 [1,1,0,0,0,0|1,0,1]=4 932 B8R0.8 CCCO[C@H](C)C(=O)N 34a_100000731257_100000210303 [1,1,0,0,0,0|1,0,1]=4 933 B8R0.8 CCCO[C@H](C)C(=O)N 7a_100000731257_100000210303 [1,1,0,0,0,0|1,0,1]=4 934 B8R0.8 CCCSC(C)C(=O)C 62a_100000210303_100009814033 [1,1,0,0,0,0|0,1,1]=4 935 B8R0.8 CCCSC(C)C(=O)C 62a_100009814033_100000210303 [1,1,0,0,0,0|0,1,1]=4 936 B8R0.8 CCOCC(C)C(=O)C 34a_100000032740_100000210202 [1,1,0,0,0,0|0,0,1]=3 937 B8R0.8 CCOCC(C)C(=O)C 7a_100000032740_100000210202 [1,1,0,0,0,0|0,0,1]=3 938 B8R0.8 COCSC(C)C(=O)C 62a_100000766300_100009814033 [1,1,0,0,0,0|0,1,1]=4 939 B8R0.8 COCSC(C)C(=O)C 62a_100009814033_100000766300 [1,1,0,0,0,0|0,1,1]=4 940 B8R0.8 CSCOC(C)C(=O)C 34a_100000212229_100011218213 [1,1,0,0,0,0|0,0,1]=3 941 B8R0.8 CSCO[C@H](C)C(=O)N 34a_100000731257_100011218213 [1,1,0,0,0,0|1,0,1]=4 942 B8R0.8 CSCSC(C)C(=O)C 62a_100009814033_100011218213 [1,1,0,0,0,0|0,1,1]=4 943 B8R0.8 CSCSC(C)C(=O)C 62a_100011218213_100009814033 [1,1,0,0,0,0|0,1,1]=4 944 B8R0.8 C[C@@H](NCC=O)C(=O)N 2230a_100000119354_200015260668 [1,1,0,0,0,0|2,0,0]=4 945 B8R0.8 C[C@@H](NCC=O)C(=O)N 34a_100000119354_200009817547 [1,1,0,0,0,0|2,0,0]=4 946 B8R0.8 C[C@@H](OCC=O)C(=O)N 34a_100000731257_200009817547 [1,1,0,0,0,0|1,0,0]=3 947 B8R0.8 C[C@@H](OCC=O)C(=O)N 7a_100000731257_200015260668 [1,1,0,0,0,0|1,0,0]=3 948 B8R0.8 C[C@@H](OCCF)C(=O)N 34a_100000731257_100011217306 [1,1,0,0,0,0|1,0,1]=4 949 B8R0.8 C[C@@H](OCCF)C(=O)N 7a_100000731257_100011217306 [1,1,0,0,0,0|1,0,1]=4 950 B8R0.8 C[C@@H](OCCO)C(=O)N 34a_100000731257_100000211926 [1,1,0,0,0,0|1,0,1]=4 951 B8R0.8 C[C@@H](OCCO)C(=O)N 7a_100000731257_100000211926 [1,1,0,0,0,0|1,0,1]=4 952 B8R0.8 C[C@H](NCC=O)C(=O)O 269956a_100000743915_200015260668 [1,1,0,0,0,0|2,0,0]=4 953 B8R0.8 C[C@H](OCC=O)C(=O)[O-] 7a_217856618621_200015260668 [1,1,0,0,0,0|1,0,0]=3 954 B8R0.8 C[C@H](OCCF)C(=O)[O-] 7a_217856618621_100011217306 [1,1,0,0,0,0|1,0,1]=4 955 B8R0.8 C[C@H](OCCO)C(=O)[O-] 7a_217856618621_100000211926 [1,1,0,0,0,0|1,0,1]=4 956 B8R0.12 C=CCC(C)(C)C(=O)C 1458a_100000705796_200000210301 [1,1,0,0,0,0|1,0,1]=4 957 B8R0.12 C=CCC(C)(C)C(=O)[13CH3] 1458a_100000705796_200025704644 [1,1,0,0,0,0|1,0,1]=4 958 B8R0.12 CC(=O)C(C)(C)OCF 34a_100000747739_100015361967 [1,1,0,0,0,0|1,0,1]=4 959 B8R0.12 CC(=O)C(C)(C)OCF 7a_100000747739_100015361967 [1,1,0,0,0,0|1,0,1]=4 960 B8R0.12 CC(C)(ON[13CH3])C(=O)O 269956a_100016989451_200025704644 [1,1,0,0,0,0|2,0,0]=4 961 B8R0.12 CCCC(C)(C)C(=O)C 1458a_100011215034_200000210301 [1,1,0,0,0,0|1,0,1]=4 962 B8R0.12 CCCC(C)(C)C(=O)[13CH3] 1458a_100011215034_200025704644 [1,1,0,0,0,0|1,0,1]=4 963 B8R0.12 CCOC(C)(C)C(=O)C 1458a_100011458965_200000210301 [1,1,0,0,0,0|0,0,1]=3 964 B8R0.12 CCOC(C)(C)C(=O)C 34a_100000747739_100000210202 [1,1,0,0,0,0|0,0,1]=3 965 B8R0.12 CCOC(C)(C)C(=O)C 7a_100000747739_100000210202 [1,1,0,0,0,0|0,0,1]=3 966 B8R0.12 CCOC(C)(C)C(=O)N 34a_100011626353_100000210202 [1,1,0,0,0,0|1,0,1]=4 967 B8R0.12 CCOC(C)(C)C(=O)N 34a_100121572206_100000702505 [1,1,0,0,0,0|1,0,1]=4 968 B8R0.12 CCOC(C)(C)C(=O)N 7a_100011626353_100000210202 [1,1,0,0,0,0|1,0,1]=4 969 B8R0.12 CCOC(C)(C)C(=O)[13CH3] 1458a_100011458965_200025704644 [1,1,0,0,0,0|0,0,1]=3 970 B8R0.12 CCSC(C)(C)C(=O)C 62a_100000075568_100000210202 [1,1,0,0,0,0|0,1,1]=4 971 B8R0.12 CCSC(C)(C)C(=O)C 62a_100000210202_100000075568 [1,1,0,0,0,0|0,1,1]=4 972 B8R0.12 CNOC(C)(C)C(=O)O 269956a_100016989451_200000210301 [1,1,0,0,0,0|2,0,0]=4 973 B8R0.15 CCCC(CC)C(=O)C 1458a_100000070787_100011219200 [1,1,0,0,0,0|1,0,1]=4 974 B8R0.15 CCCC(CC)C(=O)C 1458a_100011416436_200000210301 [1,1,0,0,0,0|1,0,1]=4 975 B8R0.15 CCCC(CC)C(=O)[13CH3] 1458a_100011416436_200025704644 [1,1,0,0,0,0|1,0,1]=4 976 B8R0.15 CCOC(CC)C(=O)N 34a_100121572206_100000750255 [1,1,0,0,0,0|1,0,1]=4 977 B8R0.9 C#CC(C)OCC(=O)C 34a_100000211253_200000035995 [1,1,0,0,0,0|1,0,1]=4 978 B8R0.9 C=C(C)CCC(=O)CC 1458a_100000210414_100000730704 [1,1,0,0,0,0|2,0,0]=4 979 B8R0.9 C=C(C)CCC(=O)CC 1458a_200000688413_100000210202 [1,1,0,0,0,0|2,0,0]=4 980 B8R0.9 C=C(C)CCC(=O)CF 1458a_200000688413_100015361967 [1,1,0,0,0,0|2,0,0]=4 981 B8R0.9 C=C(C)CCC(=O)CO 1458a_100000210174_100000730704 [1,1,0,0,0,0|2,0,0]=4 982 B8R0.9 C=C(C)CCC(=O)NC 11a_106832991635_200000688413 [1,1,0,0,0,0|2,0,0]=4 983 B8R0.9 C=C(C)CCC(=O)NC 1626a_100102657272_200000688413 [1,1,0,0,0,0|2,0,0]=4 984 B8R0.9 C=C(C)CCC(=O)NC 240690a_100102657272_200000688413 [1,1,0,0,0,0|2,0,0]=4 985 B8R0.9 C=C(C)CCC(=O)NC 527a_100102657272_200000688413 [1,1,0,0,0,0|2,0,0]=4 986 B8R0.9 C=C(C)CNC(=O)CC 11a_100000765925_100000210414 [1,1,0,0,0,0|2,0,0]=4 987 B8R0.9 C=C(C)CNC(=O)CC 1626a_100000765925_100000210414 [1,1,0,0,0,0|2,0,0]=4 988 B8R0.9 C=C(C)CNC(=O)CC 240690a_100000765925_100000210414 [1,1,0,0,0,0|2,0,0]=4 989 B8R0.9 C=C(C)CNC(=O)CC 527a_100000765925_100000210414 [1,1,0,0,0,0|2,0,0]=4 990 B8R0.9 C=C(C)CNC(=O)CO 240690a_100000765925_100000210174 [1,1,0,0,0,0|2,0,0]=4 991 B8R0.9 C=C(C)CNC(=O)CO 527a_100000765925_100000210174 [1,1,0,0,0,0|2,0,0]=4 992 B8R0.9 C=C(C)CNC(=O)NC 2708a_100000765925_106832991635 [1,1,0,0,0,0|2,0,0]=4 993 B8R0.9 C=C(C)CNC(=O)NC 2708a_100102657272_100000765925 [1,1,0,0,0,0|2,0,0]=4 994 B8R0.9 C=C(C)CNC(=O)NC 273464a_100000765925_100102657272 [1,1,0,0,0,0|2,0,0]=4 995 B8R0.9 C=C(C)CNC(=O)NC 273464a_100102657272_100000765925 [1,1,0,0,0,0|2,0,0]=4 996 B8R0.9 C=C(C)CNC(=O)NC 512a_100000765925_100102657272 [1,1,0,0,0,0|2,0,0]=4 997 B8R0.9 C=C(C)CNC(=O)NC 512a_106832991638_100000765925 [1,1,0,0,0,0|2,0,0]=4 998 B8R0.9 C=CC(=O)NCC(=O)C 1458a_200011222540_200000210301 [1,1,0,0,0,0|1,0,1]=4 999 B8R0.9 C=CC(=O)NCC(=O)[13CH3] 1458a_200011222540_200025704644 [1,1,0,0,0,0|1,0,1]=4 1000 B8R0.9 CC(=CCC(=O)CF)C 1458a_100011220947_100015361967 [1,1,0,0,0,0|2,0,0]=4 1001 B8R0.9 CC(=CCC(=O)CO)C 1458a_100000210174_100000761012 [1,1,0,0,0,0|2,0,0]=4 1002 B8R0.9 CC(=O)COC(C)CO 34a_100000211253_100012180447 [1,1,0,0,0,0|0,0,2]=4 1003 B8R0.9 CC(=O)NCC(=O)CF 1458a_100000194580_100015361967 [1,1,0,0,0,0|1,0,0]=3 1004 B8R0.9 CC(=O)NNC(=O)CO 22a_100000189765_100000210174 [1,1,0,0,0,0|2,0,0]=4 1005 B8R0.9 CC(=O)OCC(=O)CF 1458a_100000183556_100015361967 [1,1,0,0,0,0|0,0,0]=2 1006 B8R0.9 CC(=O)SCC(=O)CF 1458a_100000049016_100015361967 [1,1,0,0,0,0|0,1,0]=3 1007 B8R0.9 CC(C)OCC(=O)CF 1458a_100000745533_100015361967 [1,1,0,0,0,0|1,0,1]=4 1008 B8R0.9 CCC(=O)CC=C(C)C 1458a_100000210414_100000761012 [1,1,0,0,0,0|2,0,0]=4 1009 B8R0.9 CCC(=O)CC=C(C)C 1458a_100011220947_100000210202 [1,1,0,0,0,0|2,0,0]=4 1010 B8R0.9 CCC(=O)CCC(=O)N 1458a_100011215257_100000210202 [1,1,0,0,0,0|2,0,0]=4 1011 B8R0.9 CCC(=O)CNC(=O)C 1458a_100000194580_100000210202 [1,1,0,0,0,0|1,0,0]=3 1012 B8R0.9 CCC(=O)CNC(=O)N 1458a_100000184981_100000210202 [1,1,0,0,0,0|2,0,0]=4 1013 B8R0.9 CCC(=O)COC(=O)C 1458a_100000183556_100000210202 [1,1,0,0,0,0|0,0,0]=2 1014 B8R0.9 CCC(=O)COC(C)C 1458a_100000745533_100000210202 [1,1,0,0,0,0|1,0,1]=4 1015 B8R0.9 CCC(=O)COC(C)C 34a_100000725409_100000210206 [1,1,0,0,0,0|1,0,1]=4 1016 B8R0.9 CCC(=O)CSC(=O)C 1458a_100000049016_100000210202 [1,1,0,0,0,0|0,1,0]=3 1017 B8R0.9 CCC(=O)NCC(=O)C 1458a_100000194589_200000210301 [1,1,0,0,0,0|1,0,0]=3 1018 B8R0.9 CCC(=O)NCC(=O)N 11a_100000711301_100000210414 [1,1,0,0,0,0|2,0,0]=4 1019 B8R0.9 CCC(=O)NCC(=O)N 240690a_100000711301_100000210414 [1,1,0,0,0,0|2,0,0]=4 1020 B8R0.9 CCC(=O)NCC(=O)N 527a_100000711301_100000210414 [1,1,0,0,0,0|2,0,0]=4 1021 B8R0.9 CCC(=O)NCC(=O)[13CH3] 1458a_100000194589_200025704644 [1,1,0,0,0,0|1,0,0]=3 1022 B8R0.9 CCC(=O)NNC(=O)C 22a_100000183195_100000070787 [1,1,0,0,0,0|2,0,0]=4 1023 B8R0.9 CCC(=O)NNC(=O)C 22a_100000189765_100000210414 [1,1,0,0,0,0|2,0,0]=4 1024 B8R0.9 CCC(C)OCC(=O)C 34a_100000211253_100011215416 [1,1,0,0,0,0|1,0,1]=4 1025 B8R0.9 CCN(C)COC(=O)C 269982a_100000225621_100000076356 [1,1,0,0,0,0|2,0,0]=4 1026 B8R0.9 CCS(=O)CCC(=O)C 1458a_100011387550_200000210301 [1,1,0,0,0,0|2,0,0]=4 1027 B8R0.9 CCS(=O)CCC(=O)[13CH3] 1458a_100011387550_200025704644 [1,1,0,0,0,0|2,0,0]=4 1028 B8R0.9 CNC(=O)C=CC(=O)C 1458a_100016259477_200000210301 [1,1,0,0,0,0|1,0,1]=4 1029 B8R0.9 CNC(=O)C=CC(=O)[13CH3] 1458a_100016259477_200025704644 [1,1,0,0,0,0|1,0,1]=4 1030 B8R0.9 CNC(=O)CC=C(C)C 11a_106832991635_100011220947 [1,1,0,0,0,0|2,0,0]=4 1031 B8R0.9 CNC(=O)CC=C(C)C 1626a_100102657272_100011220947 [1,1,0,0,0,0|2,0,0]=4 1032 B8R0.9 CNC(=O)CC=C(C)C 240690a_100102657272_100011220947 [1,1,0,0,0,0|2,0,0]=4 1033 B8R0.9 CNC(=O)CC=C(C)C 527a_100102657272_100011220947 [1,1,0,0,0,0|2,0,0]=4 1034 B8R0.9 CNC(=O)CCC(=O)C 1458a_100011309844_200000210301 [1,1,0,0,0,0|1,0,0]=3 1035 B8R0.9 CNC(=O)CCC(=O)N 240690a_100102657272_100011215257 [1,1,0,0,0,0|2,0,0]=4 1036 B8R0.9 CNC(=O)CCC(=O)N 527a_100102657272_100011215257 [1,1,0,0,0,0|2,0,0]=4 1037 B8R0.9 CNC(=O)CCC(=O)[13CH3] 1458a_100011309844_200025704644 [1,1,0,0,0,0|1,0,0]=3 1038 B8R0.9 CNC(=O)CNC(=O)C 11a_100000693194_100015343762 [1,1,0,0,0,0|1,0,0]=3 1039 B8R0.9 CNC(=O)CNC(=O)C 11a_106832991635_100000194580 [1,1,0,0,0,0|1,0,0]=3 1040 B8R0.9 CNC(=O)CNC(=O)C 1626a_100102657272_100000194580 [1,1,0,0,0,0|1,0,0]=3 1041 B8R0.9 CNC(=O)CNC(=O)C 240690a_100000693194_100015343762 [1,1,0,0,0,0|1,0,0]=3 1042 B8R0.9 CNC(=O)CNC(=O)C 240690a_100102657272_100000194580 [1,1,0,0,0,0|1,0,0]=3 1043 B8R0.9 CNC(=O)CNC(=O)C 527a_100000693194_100103153847 [1,1,0,0,0,0|1,0,0]=3 1044 B8R0.9 CNC(=O)CNC(=O)C 527a_100102657272_100000194580 [1,1,0,0,0,0|1,0,0]=3 1045 B8R0.9 CNC(=O)CNC(=O)N 240690a_100102657272_100000184981 [1,1,0,0,0,0|2,0,0]=4 1046 B8R0.9 CNC(=O)CNC(=O)N 527a_100102657272_100000184981 [1,1,0,0,0,0|2,0,0]=4 1047 B8R0.9 CNC(=O)COC(=O)C 1626a_100102657272_100000183556 [1,1,0,0,0,0|0,0,0]=2 1048 B8R0.9 CNC(=O)COC(=O)C 240690a_100102657272_100000183556 [1,1,0,0,0,0|0,0,0]=2 1049 B8R0.9 CNC(=O)COC(=O)C 527a_100102657272_100000183556 [1,1,0,0,0,0|0,0,0]=2 1050 B8R0.9 CNC(=O)COC(C)C 11a_106832991635_100000745533 [1,1,0,0,0,0|1,0,1]=4 1051 B8R0.9 CNC(=O)COC(C)C 1626a_100102657272_100000745533 [1,1,0,0,0,0|1,0,1]=4 1052 B8R0.9 CNC(=O)COC(C)C 240690a_100102657272_100000745533 [1,1,0,0,0,0|1,0,1]=4 1053 B8R0.9 CNC(=O)COC(C)C 34a_100000212225_100000183359 [1,1,0,0,0,0|1,0,1]=4 1054 B8R0.9 CNC(=O)COC(C)C 34a_100000750040_100000210206 [1,1,0,0,0,0|1,0,1]=4 1055 B8R0.9 CNC(=O)COC(C)C 527a_100102657272_100000745533 [1,1,0,0,0,0|1,0,1]=4 1056 B8R0.9 CNC(=O)CSC(=O)C 11a_106832991635_100000049016 [1,1,0,0,0,0|0,1,0]=3 1057 B8R0.9 CNC(=O)CSC(=O)C 1626a_100102657272_100000049016 [1,1,0,0,0,0|0,1,0]=3 1058 B8R0.9 CNC(=O)CSC(=O)C 240690a_100102657272_100000049016 [1,1,0,0,0,0|0,1,0]=3 1059 B8R0.9 CNC(=O)CSC(=O)N 240690a_100102657272_200015941356 [1,1,0,0,0,0|1,1,0]=4 1060 B8R0.9 CNC(=O)NCC(=O)N 2708a_100102657272_100000711301 [1,1,0,0,0,0|2,0,0]=4 1061 B8R0.9 CNC(=O)NCC(=O)N 273464a_100000711301_100102657272 [1,1,0,0,0,0|2,0,0]=4 1062 B8R0.9 CNC(=O)NCC(=O)N 273464a_100102657272_100000711301 [1,1,0,0,0,0|2,0,0]=4 1063 B8R0.9 CNC(=O)NCC(=O)N 512a_106832991638_100000711301 [1,1,0,0,0,0|2,0,0]=4 1064 B8R0.9 CNC(=O)NNC(=O)C 273464a_100102657272_100000189765 [1,1,0,0,0,0|2,0,0]=4 1065 B8R0.9 CNC(=O)NNC(=O)C 512a_100000189765_100102657272 [1,1,0,0,0,0|2,0,0]=4 1066 B8R0.9 CNC(C)COC(=O)C 270004a_106832991635_100000000629 [1,1,0,0,0,0|1,0,1]=4 1067 B8R0.9 COC(=O)CCC(=O)C 1458a_100000187943_200000210301 [1,1,0,0,0,0|1,0,0]=3 1068 B8R0.9 COC(=O)CCC(=O)[13CH3] 1458a_100000187943_200025704644 [1,1,0,0,0,0|1,0,0]=3 1069 B8R0.9 COC(=O)CNC(=O)C 188690a_100000185156_100015343762 [1,1,0,0,0,0|1,0,0]=3 1070 B8R0.9 COC(=O)COC(C)C 34a_100000212225_100000747449 [1,1,0,0,0,0|1,0,1]=4 1071 B8R0.9 COC(=O)NCC(=O)C 1458a_100000215747_200000210301 [1,1,0,0,0,0|1,0,0]=3 1072 B8R0.9 COC(=O)NCC(=O)[13CH3] 1458a_100000215747_200025704644 [1,1,0,0,0,0|1,0,0]=3 1073 B8R0.9 NC(=O)CCC(=O)CF 1458a_100011215257_100015361967 [1,1,0,0,0,0|2,0,0]=4 1074 B8R0.9 NC(=O)CNC(=O)CO 240690a_100000711301_100000210174 [1,1,0,0,0,0|2,0,0]=4 1075 B8R0.9 NC(=O)CNC(=O)CO 527a_100000711301_100000210174 [1,1,0,0,0,0|2,0,0]=4 1076 B8R0.9 NC(=O)NCC(=O)CF 1458a_100000184981_100015361967 [1,1,0,0,0,0|2,0,0]=4 1077 B8R0.29 CC(=O)CCS(=O)(=O)C 1458a_100000070787_100000731031 [1,1,0,0,0,0|2,0,0]=4 1078 B8R0.29 CC(=O)CCS(=O)(=O)C 1458a_100000737124_200000210301 [1,1,0,0,0,0|2,0,0]=4 1079 B8R0.29 CC(=O)CNS(=O)(=O)C 1458a_100000737300_200000210301 [1,1,0,0,0,0|2,0,0]=4 1080 B8R0.29 CC(=O)COC(C)(C)C 1458a_100000686494_200000210301 [1,1,0,0,0,0|1,0,1]=4 1081 B8R0.29 CC(=O)COC(C)(C)C 34a_100000211253_100000210625 [1,1,0,0,0,0|1,0,1]=4 1082 B8R0.29 CC(C)(C)OCC(=O)[13CH3] 1458a_100000686494_200025704644 [1,1,0,0,0,0|1,0,1]=4 1083 B8R0.29 CS(=O)(=O)CCC(=O)[13CH3] 1458a_100000737124_200025704644 [1,1,0,0,0,0|2,0,0]=4 1084 B8R0.29 CS(=O)(=O)NCC(=O)[13CH3] 1458a_100000737300_200025704644 [1,1,0,0,0,0|2,0,0]=4 1085 B8R0.18 CC(=O)C(S[13CH3])C(=O)C 62a_100000210371_200025704644 [0,1,0,0,1,0|0,0,0]=2 1086 B8R0.18 CC(=O)C(S[13CH3])C(=O)C 62a_200025704644_100000210371 [0,1,0,0,1,0|0,0,0]=2 1087 B8R0.18 CCC(C(=O)C)C(=O)N 1458a_100000070787_100000750255 [0,1,0,0,1,0|1,0,0]=3 1088 B8R0.18 CCC(C(=O)C)N(C)C 1458a_100000689100_200000210301 [0,1,0,0,1,0|2,0,0]=4 1089 B8R0.18 CCC(C(=O)[13CH3])N(C)C 1458a_100000689100_200025704644 [0,1,0,0,1,0|2,0,0]=4 1090 B8R0.18 CNC(C(=O)N)C(=O)N 2230a_100000025885_200000210301 [0,1,0,0,1,0|2,0,0]=4 1091 B8R0.18 CSC(C(=O)C)C(=O)C 62a_100000210371_200000210301 [0,1,0,0,1,0|0,0,0]=2 1092 B8R0.18 CSC(C(=O)C)C(=O)C 62a_200000210301_100000210371 [0,1,0,0,1,0|0,0,0]=2 1093 B8R0.18 [13CH3]NC(C(=O)N)C(=O)N 2230a_100000025885_200025704644 [0,1,0,0,1,0|2,0,0]=4 1094 B8R0.37 C=C(Cl)C(C)(C)C(=O)C 1458a_100000049003_200000210301 [0,1,0,0,1,0|1,0,1]=4 1095 B8R0.37 C=C(Cl)C(C)(C)C(=O)[13CH3] 1458a_100000049003_200025704644 [0,1,0,0,1,0|1,0,1]=4 1096 B8R0.37 CC(=O)C(C)(C)N(C)C 1458a_100000688961_200000210301 [0,1,0,0,1,0|2,0,0]=4 1097 B8R0.37 CC(=O)C(C)(C)N(C)C 269982a_100102631434_100000075568 [0,1,0,0,1,0|2,0,0]=4 1098 B8R0.37 CC(=O)C(F)(F)C(=O)N 1458a_100000070787_100009811971 [0,1,0,0,1,0|2,0,0]=4 1099 B8R0.37 CN(C)C(C)(C)C(=O)[13CH3] 1458a_100000688961_200025704644 [0,1,0,0,1,0|2,0,0]=4 1100 B10R0.13 C=C(C)CN(C)C(C)C(=O)C 2230a_100000225649_100009814033 [0,1,0,0,0,1|2,0,0]=4 1101 B10R0.13 C=C(C)CN(C)C(C)C(=O)C 269982a_100000225649_100009814033 [0,1,0,0,0,1|2,0,0]=4 1102 B10R0.13 CC(=O)C(C)C(=O)C=C(C)C 1458a_100000211388_100000179758 [0,1,0,0,0,1|2,0,0]=4 1103 B10R0.13 CC(=O)C(C)C(=O)C=C(C)Cl 1458a_200042562850_100000179758 [0,1,0,0,0,1|2,0,0]=4 1104 B10R0.13 CC(=O)C(C)C(=O)C=C(C)I 1458a_100025716642_100000179758 [0,1,0,0,0,1|2,0,0]=4 1105 B10R0.13 CC(=O)C(C)C(=O)CC(=O)N 1458a_100134613110_100000179758 [0,1,0,0,0,1|2,0,0]=4 1106 B10R0.13 CC(=O)C(C)C(=O)NC(=O)N 1458a_100000070787_100000183865 [0,1,0,0,0,1|2,0,0]=4 1107 B10R0.13 CC(=O)C(C)N(C)CC(=O)N 2230a_100000739694_100009814033 [0,1,0,0,0,1|2,0,0]=4 1108 B10R0.13 CC(=O)C(C)N(C)CC(=O)O 269956a_100000746989_100009814033 [0,1,0,0,0,1|2,0,0]=4 1109 B10R0.43 C=C(C)COC(C)(C)C(=O)C 34a_100000747739_100000748629 [0,1,0,0,0,1|1,0,0]=3 1110 B10R0.43 C=C(C)COC(C)(C)C(=O)C 7a_100000747739_100000748629 [0,1,0,0,0,1|1,0,0]=3 1111 B10R0.43 C=C(C)COC(C)(C)C(=O)N 34a_100000210245_100000702505 [0,1,0,0,0,1|2,0,0]=4 1112 B10R0.43 C=C(C)COC(C)(C)C(=O)N 34a_100011626353_100000748629 [0,1,0,0,0,1|2,0,0]=4 1113 B10R0.43 C=C(C)COC(C)(C)C(=O)N 7a_100011626353_100000748629 [0,1,0,0,0,1|2,0,0]=4 1114 B10R0.43 C=C(C)CSC(C)(C)C(=O)C 62a_100000075568_100000211660 [0,1,0,0,0,1|1,1,0]=4 1115 B10R0.43 C=C(C)CSC(C)(C)C(=O)C 62a_100000748629_100000075568 [0,1,0,0,0,1|1,1,0]=4 1116 B10R0.43 C=C(F)COC(C)(C)C(=O)C 34a_100000747739_100009893438 [0,1,0,0,0,1|1,0,1]=4 1117 B10R0.43 C=C(F)COC(C)(C)C(=O)C 7a_100000747739_100000042424 [0,1,0,0,0,1|1,0,1]=4 1118 B10R0.43 CC(=O)C(C)(C)NCC(=O)O 269956a_100016091260_100000075568 [0,1,0,0,0,1|2,0,0]=4 1119 B10R0.43 CC(=O)C(C)(C)OCC(=O)N 34a_100000747739_100000187820 [0,1,0,0,0,1|1,0,0]=3 1120 B10R0.43 CC(=O)C(C)(C)OCC(=O)N 7a_100000747739_100000187820 [0,1,0,0,0,1|1,0,0]=3 1121 B10R0.43 CC(=O)C(C)(C)OCC(=O)[O-] 34a_100000747739_100020667443 [0,1,0,0,0,1|1,0,0]=3 1122 B10R0.43 CC(=O)C(C)(C)OCC(C)C 34a_100000747739_100000210624 [0,1,0,0,0,1|1,0,1]=4 1123 B10R0.43 CC(=O)C(C)(C)OCC(C)C 7a_100000747739_100000210760 [0,1,0,0,0,1|1,0,1]=4 1124 B10R0.43 CC(=O)C(C)(C)OCC(C)O 34a_100000747739_100011218427 [0,1,0,0,0,1|0,0,2]=4 1125 B10R0.43 CC(=O)C(C)(C)OCC(C)O 7a_100000747739_100011218427 [0,1,0,0,0,1|0,0,2]=4 1126 B10R0.43 CC(=O)C(C)(C)OC[C@@H](C)O 34a_100000747739_100009817552 [0,1,0,0,0,1|0,0,2]=4 1127 B10R0.43 CC(=O)C(C)(C)OC[C@@H](C)O 7a_100000747739_100009817552 [0,1,0,0,0,1|0,0,2]=4 1128 B10R0.43 CC(=O)C(C)(C)OC[N+](=O)[O-] 34a_100000747739_100000761209 [0,1,0,0,0,1|2,0,0]=4 1129 B10R0.43 CC(=O)C(C)(C)SCC(=O)N 62a_100000075568_100000747473 [0,1,0,0,0,1|1,1,0]=4 1130 B10R0.43 CC(=O)C(C)(C)SCC(=O)N 62a_100000747473_100000075568 [0,1,0,0,0,1|1,1,0]=4 1131 B10R0.43 CC(=O)C(C)(C)SCC(=O)[O-] 62a_100000075568_100020667443 [0,1,0,0,0,1|1,1,0]=4 1132 B10R0.43 CC(=O)C(C)(C)SCC(=O)[O-] 62a_100020667443_100000075568 [0,1,0,0,0,1|1,1,0]=4 1133 B10R0.43 CC(=O)COC(C)(C)C(=O)N 34a_100000211253_100000702505 [0,1,0,0,0,1|1,0,0]=3 1134 B10R0.43 CC(=O)COC(F)(F)C(=O)[O-] 34a_100000211253_100020612412 [0,1,0,0,0,1|2,0,0]=4 1135 B10R0.43 CC(=O)NCC(C)(C)C(=O)N 11a_100000740840_100015343762 [0,1,0,0,0,1|2,0,0]=4 1136 B10R0.43 CC(=O)NCC(C)(C)C(=O)N 1626a_100000740840_100015343762 [0,1,0,0,0,1|2,0,0]=4 1137 B10R0.43 CC(=O)NCC(C)(C)C(=O)N 240690a_100000740840_100015343762 [0,1,0,0,0,1|2,0,0]=4 1138 B10R0.43 CC(=O)NCC(C)(C)C(=O)N 527a_100000740840_100103153847 [0,1,0,0,0,1|2,0,0]=4 1139 B10R0.43 CC(C)(OCC(=O)N)C(=O)N 34a_100011626353_100000187820 [0,1,0,0,0,1|2,0,0]=4 1140 B10R0.43 CC(C)(OCC(=O)N)C(=O)N 7a_100011626353_100000187820 [0,1,0,0,0,1|2,0,0]=4 1141 B10R0.43 CC(C)(OCC(=O)[O-])C(=O)N 34a_100011626353_100020667443 [0,1,0,0,0,1|2,0,0]=4 1142 B10R0.57 C=C(C)CN[C@H](C)C(=O)NC 2230a_100000684985_100000748629 [0,1,0,0,0,1|2,0,0]=4 1143 B10R0.57 C=C(C)CN[C@H](C)C(=O)NC 34a_100000684985_100000748629 [0,1,0,0,0,1|2,0,0]=4 1144 B10R0.57 C=C(C)COC(C)C(=O)NC 34a_100000210245_100000731044 [0,1,0,0,0,1|1,0,0]=3 1145 B10R0.57 C=C(C)COC(C)C(=O)NN 34a_100000725659_100000748629 [0,1,0,0,0,1|2,0,0]=4 1146 B10R0.57 C=C(C)COC(C)C(=O)OC 34a_100000210245_100000211248 [0,1,0,0,0,1|1,0,0]=3 1147 B10R0.57 C=C(C)COC(C)C(=O)OC 34a_100011215400_100000748629 [0,1,0,0,0,1|1,0,0]=3 1148 B10R0.57 C=C(C)COC(F)C(=O)NC 34a_100000210245_100009813575 [0,1,0,0,0,1|2,0,0]=4 1149 B10R0.57 C=C(C)CSC(C)C(=O)CC 62a_100000742827_100000211660 [0,1,0,0,0,1|1,1,0]=4 1150 B10R0.57 C=C(C)CSC(C)C(=O)CC 62a_100000748629_100000742827 [0,1,0,0,0,1|1,1,0]=4 1151 B10R0.57 C=C(C)CSC(C)C(=O)NC 62a_100000209862_100000211660 [0,1,0,0,0,1|1,1,0]=4 1152 B10R0.57 C=C(C)CSC(C)C(=O)NC 62a_100000748629_100000731044 [0,1,0,0,0,1|1,1,0]=4 1153 B10R0.57 C=C(C)CSC(C)C(=O)OC 62a_100000211248_100000211660 [0,1,0,0,0,1|1,1,0]=4 1154 B10R0.57 C=C(C)CSC(C)C(=O)OC 62a_100000748629_100000211248 [0,1,0,0,0,1|1,1,0]=4 1155 B10R0.57 C=C(F)COC(C)C(=O)NC 34a_200010262243_100000731044 [0,1,0,0,0,1|1,0,1]=4 1156 B10R0.57 C=C(F)COC(C)C(=O)OC 34a_100011215400_100009893438 [0,1,0,0,0,1|1,0,1]=4 1157 B10R0.57 C=C(F)COC(C)C(=O)OC 34a_200010262243_100000211248 [0,1,0,0,0,1|1,0,1]=4 1158 B10R0.57 CC(=O)SC[C@@H](C)C(=O)CF 1458a_200015407212_100015361967 [0,1,0,0,0,1|0,1,0]=3 1159 B10R0.57 CC(OCC(=O)N)C(=O)NN 34a_100000725659_100000187820 [0,1,0,0,0,1|2,0,0]=4 1160 B10R0.57 CC(OCC(=O)[O-])C(=O)NN 34a_100000725659_100020667443 [0,1,0,0,0,1|2,0,0]=4 1161 B10R0.57 CCC(=O)C(C)NCC(=O)N 2230a_100000711301_100000742827 [0,1,0,0,0,1|2,0,0]=4 1162 B10R0.57 CCC(=O)C(C)NCC(=O)O 269956a_100016091260_100000742827 [0,1,0,0,0,1|2,0,0]=4 1163 B10R0.57 CCC(=O)C(C)SCC(=O)N 62a_100000742827_100000747473 [0,1,0,0,0,1|1,1,0]=4 1164 B10R0.57 CCC(=O)C(C)SCC(=O)N 62a_100000747473_100000742827 [0,1,0,0,0,1|1,1,0]=4 1165 B10R0.57 CCC(=O)C(C)SCC(=O)[O-] 62a_100000742827_100020667443 [0,1,0,0,0,1|1,1,0]=4 1166 B10R0.57 CCC(=O)C(C)SCC(=O)[O-] 62a_100020667443_100000742827 [0,1,0,0,0,1|1,1,0]=4 1167 B10R0.57 CCC(=O)[C@H](C)CSC(=O)C 1458a_200015407212_100000210202 [0,1,0,0,0,1|0,1,0]=3 1168 B10R0.57 CNC(=O)C(C)CNC(=O)C 11a_100015187722_100015343762 [0,1,0,0,0,1|1,0,0]=3 1169 B10R0.57 CNC(=O)C(C)CNC(=O)C 240690a_100015187722_100015343762 [0,1,0,0,0,1|1,0,0]=3 1170 B10R0.57 CNC(=O)C(C)CNC(=O)C 527a_100015187722_100103153847 [0,1,0,0,0,1|1,0,0]=3 1171 B10R0.57 CNC(=O)C(C)NCC(=O)N 2230a_100000711301_100000731044 [0,1,0,0,0,1|2,0,0]=4 1172 B10R0.57 CNC(=O)C(C)NCC(=O)O 269956a_100016091260_100000209862 [0,1,0,0,0,1|2,0,0]=4 1173 B10R0.57 CNC(=O)C(C)OCC(=O)C 34a_100000211253_100000731044 [0,1,0,0,0,1|0,0,0]=2 1174 B10R0.57 CNC(=O)C(C)OCC(C)Br 34a_100012180447_100000731044 [0,1,0,0,0,1|1,0,1]=4 1175 B10R0.57 CNC(=O)C(C)OCC(C)C 34a_100000210257_100000731044 [0,1,0,0,0,1|1,0,1]=4 1176 B10R0.57 CNC(=O)C(C)OCC(C)F 34a_100015925927_100000731044 [0,1,0,0,0,1|1,0,1]=4 1177 B10R0.57 CNC(=O)C(C)OC[C@@H](C)Cl 34a_100016084084_100000731044 [0,1,0,0,0,1|1,0,1]=4 1178 B10R0.57 CNC(=O)C(C)OC[C@@H](C)N 34a_100000737577_100000731044 [0,1,0,0,0,1|1,0,1]=4 1179 B10R0.57 CNC(=O)C(C)SCC(=O)N 62a_100000209862_100000747473 [0,1,0,0,0,1|1,1,0]=4 1180 B10R0.57 CNC(=O)C(C)SCC(=O)N 62a_100000747473_100000731044 [0,1,0,0,0,1|1,1,0]=4 1181 B10R0.57 CNC(=O)C(C)SCC(=O)[O-] 62a_100000209862_100020667443 [0,1,0,0,0,1|1,1,0]=4 1182 B10R0.57 CNC(=O)C(C)SCC(=O)[O-] 62a_100020667443_100000731044 [0,1,0,0,0,1|1,1,0]=4 1183 B10R0.57 CNC(=O)C(F)OCC(=O)C 34a_100000211253_100009813575 [0,1,0,0,0,1|1,0,0]=3 1184 B10R0.57 CNC(=O)[C@@H](C)NCC(=O)N 2230a_100000684985_100000747473 [0,1,0,0,0,1|2,0,0]=4 1185 B10R0.57 CNC(=O)[C@@H](C)NCC(=O)N 34a_100000684985_100000187820 [0,1,0,0,0,1|2,0,0]=4 1186 B10R0.57 CNC(=O)[C@@H](C)NCC(=O)[O-] 34a_100000684985_100020667443 [0,1,0,0,0,1|2,0,0]=4 1187 B10R0.57 CNC(=O)[C@H](C)CSC(=O)C 11a_106832991635_200015407212 [0,1,0,0,0,1|0,1,0]=3 1188 B10R0.57 CNC(=O)[C@H](C)CSC(=O)C 1626a_100102657272_200015407212 [0,1,0,0,0,1|0,1,0]=3 1189 B10R0.57 CNC(=O)[C@H](C)CSC(=O)C 240690a_100102657272_200015407212 [0,1,0,0,0,1|0,1,0]=3 1190 B10R0.57 CNC(=O)[C@H](C)CSC(=O)C 527a_100102657272_200015407212 [0,1,0,0,0,1|0,1,0]=3 1191 B10R0.57 COC(=O)C(=NNC(=O)C)C 4a_100000189765_100000211753 [0,1,0,0,0,1|1,0,1]=4 1192 B10R0.57 COC(=O)C(C)CCC(=O)C 1458a_100000070787_100000034942 [0,1,0,0,0,1|1,0,0]=3 1193 B10R0.57 COC(=O)C(C)COC(C)C 34a_100000212225_100000698445 [0,1,0,0,0,1|1,0,1]=4 1194 B10R0.57 COC(=O)C(C)COC(C)C 34a_100000749362_100000210206 [0,1,0,0,0,1|1,0,1]=4 1195 B10R0.57 COC(=O)C(C)COC(C)C 7a_100000749362_100000210206 [0,1,0,0,0,1|1,0,1]=4 1196 B10R0.57 COC(=O)C(C)NCC(=O)N 2230a_100000711301_100000211248 [0,1,0,0,0,1|2,0,0]=4 1197 B10R0.57 COC(=O)C(C)OCC(=O)C 34a_100000211253_100000211248 [0,1,0,0,0,1|0,0,0]=2 1198 B10R0.57 COC(=O)C(C)OCC(=O)N 34a_100011215400_100000187820 [0,1,0,0,0,1|1,0,0]=3 1199 B10R0.57 COC(=O)C(C)OCC(=O)[O-] 34a_100011215400_100020667443 [0,1,0,0,0,1|1,0,0]=3 1200 B10R0.57 COC(=O)C(C)OCC(C)Br 34a_100012180447_100000211248 [0,1,0,0,0,1|1,0,1]=4 1201 B10R0.57 COC(=O)C(C)OCC(C)C 34a_100000210257_100000211248 [0,1,0,0,0,1|1,0,1]=4 1202 B10R0.57 COC(=O)C(C)OCC(C)C 34a_100011215400_100000210624 [0,1,0,0,0,1|1,0,1]=4 1203 B10R0.57 COC(=O)C(C)OCC(C)F 34a_100015925927_100000211248 [0,1,0,0,0,1|1,0,1]=4 1204 B10R0.57 COC(=O)C(C)OCC(C)O 34a_100011215400_100011218427 [0,1,0,0,0,1|0,0,2]=4 1205 B10R0.57 COC(=O)C(C)OC[C@@H](C)Cl 34a_100016084084_100000211248 [0,1,0,0,0,1|1,0,1]=4 1206 B10R0.57 COC(=O)C(C)OC[C@@H](C)N 34a_100000737577_100000211248 [0,1,0,0,0,1|1,0,1]=4 1207 B10R0.57 COC(=O)C(C)OC[C@@H](C)O 34a_100011215400_100009817552 [0,1,0,0,0,1|0,0,2]=4 1208 B10R0.57 COC(=O)C(C)OC[N+](=O)[O-] 34a_100011215400_100000761209 [0,1,0,0,0,1|2,0,0]=4 1209 B10R0.57 COC(=O)C(C)SCC(=O)N 62a_100000211248_100000747473 [0,1,0,0,0,1|1,1,0]=4 1210 B10R0.57 COC(=O)C(C)SCC(=O)N 62a_100000747473_100000211248 [0,1,0,0,0,1|1,1,0]=4 1211 B10R0.57 COC(=O)C(C)SCC(=O)[O-] 62a_100000211248_100020667443 [0,1,0,0,0,1|1,1,0]=4 1212 B10R0.57 COC(=O)C(C)SCC(=O)[O-] 62a_100020667443_100000211248 [0,1,0,0,0,1|1,1,0]=4 1213 B10R0.57 COC(=O)C(O)CNC(=O)C 188690a_100000695228_100015343762 [0,1,0,0,0,1|2,0,0]=4 1214 B10R0.82 C#CC(C)OCC(C)C(=O)C 34a_100000032740_200000035995 [0,1,0,0,0,1|1,0,1]=4 1215 B10R0.82 C=C(C#N)COC(C)C(=O)C 34a_100000212229_100000694840 [0,1,0,0,0,1|1,0,1]=4 1216 B10R0.82 C=C(C)C(C)NCC(=O)NC 269862a_100000693194_100011216138 [0,1,0,0,0,1|2,0,0]=4 1217 B10R0.82 C=CC(C)COC(C)C(=O)C 7a_100011215527_100000179758 [0,1,0,0,0,1|1,0,1]=4 1218 B10R0.82 CC(=O)C(C)COC(C)C#N 7a_100000032740_100000703298 [0,1,0,0,0,1|1,0,1]=4 1219 B10R0.82 CC(=O)C(C)COC(C)CO 34a_100000032740_100012180447 [0,1,0,0,0,1|0,0,2]=4 1220 B10R0.82 CC(=O)C(C)COC(C)CO 7a_100000032740_100012180447 [0,1,0,0,0,1|0,0,2]=4 1221 B10R0.82 CC(=O)C(C)OCC(O)CO 34a_100000212229_100011219619 [0,1,0,0,0,1|0,0,2]=4 1222 B10R0.82 CC(=O)C(C)OC[C@@H](C)CO 34a_100000212229_100000059175 [0,1,0,0,0,1|0,0,2]=4 1223 B10R0.82 CC(=O)C(C)OC[C@@H](O)CF 34a_100000212229_100015614560 [0,1,0,0,0,1|0,0,2]=4 1224 B10R0.82 CC(=O)C(C)OC[C@@H](O)CO 34a_100000212229_100009815848 [0,1,0,0,0,1|0,0,2]=4 1225 B10R0.82 CC(=O)N(C)CCC(=O)CF 1458a_100011216537_100015361967 [0,1,0,0,0,1|2,0,0]=4 1226 B10R0.82 CCC(=O)CCN(C)C(=O)C 1458a_100011216537_100000210202 [0,1,0,0,0,1|2,0,0]=4 1227 B10R0.82 CCC(=O)CN[C@@H](C)C(=O)O 269956a_100000743915_100000747405 [0,1,0,0,0,1|2,0,0]=4 1228 B10R0.82 CCC(=O)COC(C)C(=O)N 34a_100000725409_100000702099 [0,1,0,0,0,1|1,0,0]=3 1229 B10R0.82 CCC(=O)COC(C)C(C)C 7a_100000748068_100000747405 [0,1,0,0,0,1|1,0,1]=4 1230 B10R0.82 CCC(=O)COC(F)C(=O)N 34a_100000725409_100009813875 [0,1,0,0,0,1|2,0,0]=4 1231 B10R0.82 CCC(=O)COC(F)C(=O)[O-] 34a_100000725409_100020610796 [0,1,0,0,0,1|2,0,0]=4 1232 B10R0.82 CCC(=O)CO[C@@H](C)C(=O)[O-] 7a_217856618621_100000747405 [0,1,0,0,0,1|1,0,0]=3 1233 B10R0.82 CCC(=O)CO[C@H](C)C(=O)N 7a_100000731257_100000747405 [0,1,0,0,0,1|1,0,0]=3 1234 B10R0.82 CCC(=O)CSC(C)C(=O)C 62a_100000747405_100009814033 [0,1,0,0,0,1|0,1,0]=3 1235 B10R0.82 CCC(=O)CSC(C)C(=O)C 62a_100009814033_100000747405 [0,1,0,0,0,1|0,1,0]=3 1236 B10R0.82 CCC(=O)CSC(C)C(=O)N 62a_100000702099_100000747405 [0,1,0,0,0,1|1,1,0]=4 1237 B10R0.82 CCC(=O)CSC(C)C(=O)N 62a_100000747405_100000702099 [0,1,0,0,0,1|1,1,0]=4 1238 B10R0.82 CCC(C)COC(C)C(=O)C 34a_100000212229_100000748023 [0,1,0,0,0,1|1,0,1]=4 1239 B10R0.82 CCC(C)OCC(C)C(=O)C 34a_100000032740_100011215416 [0,1,0,0,0,1|1,0,1]=4 1240 B10R0.82 CCC(C)OCC(C)C(=O)C 7a_100000032740_100000758301 [0,1,0,0,0,1|1,0,1]=4 1241 B10R0.82 CCC(O)COC(C)C(=O)C 34a_100000212229_100011218378 [0,1,0,0,0,1|0,0,2]=4 1242 B10R0.82 CC[C@H](C)COC(C)C(=O)C 34a_100000212229_100009816398 [0,1,0,0,0,1|1,0,1]=4 1243 B10R0.82 CC[C@H](C)COC(C)C(=O)C 7a_100009816381_100000179758 [0,1,0,0,0,1|1,0,1]=4 1244 B10R0.82 CNC(=O)CCN(C)C(=O)C 11a_100000750875_100015343762 [0,1,0,0,0,1|2,0,0]=4 1245 B10R0.82 CNC(=O)CCN(C)C(=O)C 11a_106832991635_100011216537 [0,1,0,0,0,1|2,0,0]=4 1246 B10R0.82 CNC(=O)CCN(C)C(=O)C 1626a_100102657272_100011216537 [0,1,0,0,0,1|2,0,0]=4 1247 B10R0.82 CNC(=O)CCN(C)C(=O)C 240690a_100000750875_100015343762 [0,1,0,0,0,1|2,0,0]=4 1248 B10R0.82 CNC(=O)CCN(C)C(=O)C 240690a_100102657272_100011216537 [0,1,0,0,0,1|2,0,0]=4 1249 B10R0.82 CNC(=O)CCN(C)C(=O)C 527a_100000750875_100103153847 [0,1,0,0,0,1|2,0,0]=4 1250 B10R0.82 CNC(=O)CNC(C)C(=O)C 2230a_100000693194_100009814033 [0,1,0,0,0,1|1,0,0]=3 1251 B10R0.82 CNC(=O)CNC(C)C(=O)N 2230a_100000693194_100000702099 [0,1,0,0,0,1|2,0,0]=4 1252 B10R0.82 CNC(=O)CN[C@@H](C)C(=O)O 269956a_100000743915_100000183359 [0,1,0,0,0,1|2,0,0]=4 1253 B10R0.82 CNC(=O)CN[C@H](C)C(=O)N 2230a_100000119354_100000183359 [0,1,0,0,0,1|2,0,0]=4 1254 B10R0.82 CNC(=O)CN[C@H](C)C(=O)N 34a_100000119354_100000183359 [0,1,0,0,0,1|2,0,0]=4 1255 B10R0.82 CNC(=O)COC(C)C(=O)C 34a_100000212229_100000183359 [0,1,0,0,0,1|0,0,0]=2 1256 B10R0.82 CNC(=O)COC(C)C(=O)N 34a_100000750040_100000702099 [0,1,0,0,0,1|1,0,0]=3 1257 B10R0.82 CNC(=O)COC(C)C(C)C 7a_100000748068_100000183359 [0,1,0,0,0,1|1,0,1]=4 1258 B10R0.82 CNC(=O)COC(F)C(=O)N 34a_100000750040_100009813875 [0,1,0,0,0,1|2,0,0]=4 1259 B10R0.82 CNC(=O)COC(F)C(=O)[O-] 34a_100000750040_100020610796 [0,1,0,0,0,1|2,0,0]=4 1260 B10R0.82 CNC(=O)CO[C@@H](C)C(=O)[O-] 7a_217856618621_100000183359 [0,1,0,0,0,1|1,0,0]=3 1261 B10R0.82 CNC(=O)CO[C@H](C)C(=O)N 34a_100000731257_100000183359 [0,1,0,0,0,1|1,0,0]=3 1262 B10R0.82 CNC(=O)CO[C@H](C)C(=O)N 7a_100000731257_100000183359 [0,1,0,0,0,1|1,0,0]=3 1263 B10R0.82 CNC(=O)CSC(C)C(=O)C 62a_100000183359_100009814033 [0,1,0,0,0,1|0,1,0]=3 1264 B10R0.82 CNC(=O)CSC(C)C(=O)C 62a_100009814033_100000183359 [0,1,0,0,0,1|0,1,0]=3 1265 B10R0.82 CNC(=O)CSC(C)C(=O)N 62a_100000183359_100000702099 [0,1,0,0,0,1|1,1,0]=4 1266 B10R0.82 CNC(=O)CSC(C)C(=O)N 62a_100000702099_100000183359 [0,1,0,0,0,1|1,1,0]=4 1267 B10R0.82 COC(=O)CCN(C)C(=O)C 11a_100025711912_100015343762 [0,1,0,0,0,1|2,0,0]=4 1268 B10R0.82 COC(=O)CCN(C)C(=O)C 1626a_100025711912_100015343762 [0,1,0,0,0,1|2,0,0]=4 1269 B10R0.82 COC(=O)CCN(C)C(=O)C 240690a_100025711912_100015343762 [0,1,0,0,0,1|2,0,0]=4 1270 B10R0.82 COC(=O)CCN(C)C(=O)C 527a_100025711912_100103153847 [0,1,0,0,0,1|2,0,0]=4 1271 B10R0.82 COC(=O)CN[C@@H](C)C(=O)O 269956a_100000743915_100000747449 [0,1,0,0,0,1|2,0,0]=4 1272 B10R0.82 COC(=O)CN[C@H](C)C(=O)N 2230a_100000119354_100000747449 [0,1,0,0,0,1|2,0,0]=4 1273 B10R0.82 COC(=O)CN[C@H](C)C(=O)N 34a_100000119354_100000747449 [0,1,0,0,0,1|2,0,0]=4 1274 B10R0.82 COC(=O)COC(C)C(=O)C 34a_100000212229_100000747449 [0,1,0,0,0,1|0,0,0]=2 1275 B10R0.82 COC(=O)COC(C)C(C)C 7a_100000748068_100000747449 [0,1,0,0,0,1|1,0,1]=4 1276 B10R0.82 COC(=O)CO[C@@H](C)C(=O)[O-] 7a_217856618621_100000747449 [0,1,0,0,0,1|1,0,0]=3 1277 B10R0.82 COC(=O)CO[C@H](C)C(=O)N 34a_100000731257_100000747449 [0,1,0,0,0,1|1,0,0]=3 1278 B10R0.82 COC(=O)CO[C@H](C)C(=O)N 7a_100000731257_100000747449 [0,1,0,0,0,1|1,0,0]=3 1279 B10R0.82 COC(=O)CSC(C)C(=O)C 62a_100000747449_100009814033 [0,1,0,0,0,1|0,1,0]=3 1280 B10R0.82 COC(=O)CSC(C)C(=O)C 62a_100009814033_100000747449 [0,1,0,0,0,1|0,1,0]=3 1281 B10R0.82 COC(=O)CSC(C)C(=O)N 62a_100000702099_100000747449 [0,1,0,0,0,1|1,1,0]=4 1282 B10R0.82 COC(=O)CSC(C)C(=O)N 62a_100000747449_100000702099 [0,1,0,0,0,1|1,1,0]=4 1283 B10R0.84 C=C(C)COC(CC)C(=O)N 34a_100000210245_100000750255 [0,1,0,0,0,1|2,0,0]=4 1284 B10R0.84 CCC(OCC(=O)C)C(=O)N 34a_100000211253_100000750255 [0,1,0,0,0,1|1,0,0]=3 1285 B10R0.92 CC(=O)C(C)COC(C)(C)C 34a_100000032740_100000210625 [0,1,0,0,0,1|1,0,1]=4 1286 B10R0.92 CC(=O)C(C)OCC(C)(C)C 34a_100000212229_100011219605 [0,1,0,0,0,1|1,0,1]=4 1287 B10R0.92 CC(=O)C(C)OCC(C)(C)F 34a_100000212229_100011997219 [0,1,0,0,0,1|1,0,1]=4 1288 B10R0.92 CC(=O)C(C)OCC(C)(C)O 34a_100000212229_100000764493 [0,1,0,0,0,1|0,0,2]=4 1289 B10R0.92 CC(=O)C(C)OCS(=O)(=O)[O-] 34a_100000212229_100009817235 [0,1,0,0,0,1|2,0,0]=4 1290 B10R0.93 CC(=O)C(C)N[C@@H](C)C(=O)O 269956a_100000743915_100009814033 [0,1,0,0,0,1|2,0,0]=4 1291 B10R0.93 CC(=O)C(C)N[C@H](C)C(=O)N 2230a_100000119354_100009814033 [0,1,0,0,0,1|2,0,0]=4 1292 B10R0.93 CC(=O)C(C)OC(C)C(=O)N 34a_100000212229_100000702099 [0,1,0,0,0,1|1,0,0]=3 1293 B10R0.93 CC(=O)C(C)OC(C)C(C)C 7a_100000748068_100000179758 [0,1,0,0,0,1|1,0,1]=4 1294 B10R0.93 CC(=O)C(C)OC(F)C(=O)N 34a_100000212229_100009813875 [0,1,0,0,0,1|1,0,0]=3 1295 B10R0.93 CC(=O)C(C)OC(F)C(=O)[O-] 34a_100000212229_100020610796 [0,1,0,0,0,1|1,0,0]=3 1296 B10R0.93 CC(=O)C(C)O[C@@H](C)C(=O)[O-] 7a_217856618621_100000179758 [0,1,0,0,0,1|1,0,0]=3 1297 B10R0.93 CC(=O)C(C)O[C@H](C)C(=O)N 7a_100000731257_100000179758 [0,1,0,0,0,1|1,0,0]=3 1298 B10R0.93 CC(=O)C(C)SC(C)C(=O)C 62a_100009814033_100009814033 [0,1,0,0,0,1|0,1,0]=3 1299 B10R0.93 CC(=O)C(C)SC(C)C(=O)N 62a_100000702099_100009814033 [0,1,0,0,0,1|1,1,0]=4 1300 B10R0.93 CC(=O)C(C)SC(C)C(=O)N 62a_100009814033_100000702099 [0,1,0,0,0,1|1,1,0]=4 1301 B10R0.93 CC(=O)C(C)SC(F)C(=O)N 62a_100009813875_100009814033 [0,1,0,0,0,1|1,1,0]=4 1302 B10R0.93 CC(=O)C(C)SC(F)C(=O)N 62a_100009814033_100009813875 [0,1,0,0,0,1|1,1,0]=4 1303 B10R0.93 CC(=O)C(C)SC(F)C(=O)[O-] 62a_100009814033_100020610796 [0,1,0,0,0,1|1,1,0]=4 1304 B10R0.93 CC(=O)C(C)SC(F)C(=O)[O-] 62a_100020610796_100009814033 [0,1,0,0,0,1|1,1,0]=4 1305 B10R0.93 CC(O[C@@H](C)C(=O)[O-])C(=O)N 7a_217856618621_100000702099 [0,1,0,0,0,1|2,0,0]=4 1306 B10R0.93 CC(O[C@H](C)C(=O)N)C(=O)N 34a_100000731257_100000702099 [0,1,0,0,0,1|2,0,0]=4 1307 B10R0.93 CC(O[C@H](C)C(=O)N)C(=O)N 7a_100000731257_100000702099 [0,1,0,0,0,1|2,0,0]=4 1308 B10R0.93 C[C@@H](OC(F)C(=O)N)C(=O)N 34a_100000731257_100009813875 [0,1,0,0,0,1|2,0,0]=4 1309 B10R0.93 C[C@@H](OC(F)C(=O)N)C(=O)N 7a_100000731257_100009813875 [0,1,0,0,0,1|2,0,0]=4 1310 B10R0.93 C[C@@H](OC(F)C(=O)[O-])C(=O)N 34a_100000731257_100020610796 [0,1,0,0,0,1|2,0,0]=4 1311 B10R0.93 C[C@H](OC(F)C(=O)N)C(=O)[O-] 7a_217856618621_100009813875 [0,1,0,0,0,1|2,0,0]=4 1312 B10R0.31 CC(=O)OC(C)SC(C)(C)C 62a_100000211941_100009818208 [0,1,0,0,0,1|1,0,1]=4 1313 B10R0.31 CC(=O)OC(C)SC(C)(C)C 62a_100009818208_100000211941 [0,1,0,0,0,1|1,0,1]=4 1314 B10R0.44 C#CC(C)SC(C)OC(=O)C 62a_200000035995_100009818208 [0,1,0,0,0,1|1,0,1]=4 1315 B10R0.44 C=CC(C)SC(C)OC(=O)C 62a_100011215867_100009818208 [0,1,0,0,0,1|1,0,1]=4 1316 B10R0.44 CC(=O)OC(C)SC(C)C#N 62a_100000703298_100009818208 [0,1,0,0,0,1|1,0,1]=4 1317 B10R0.44 CC(=O)OC(C)SC(C)C#N 62a_100009818208_100000703298 [0,1,0,0,0,1|1,0,1]=4 1318 B10R0.44 CC(=O)OC(C)SC(C)CO 62a_100012180447_100009818208 [0,1,0,0,0,1|0,0,2]=4 1319 B10R0.44 CC(=O)OC(C)S[C@H](C)CO 62a_100009818208_100016084084 [0,1,0,0,0,1|0,0,2]=4 1320 B10R0.44 CC(=O)OC(C)S[C@H](C)CO 62a_100016084084_100009818208 [0,1,0,0,0,1|0,0,2]=4 1321 B10R0.44 CCC(C)SC(C)OC(=O)C 62a_100000758301_100009818208 [0,1,0,0,0,1|1,0,1]=4 1322 B10R0.44 CCC(C)SC(C)OC(=O)C 62a_100009818208_100000758301 [0,1,0,0,0,1|1,0,1]=4 1323 B10R0.44 COC(=O)CC(C)CC(=O)C 1458a_100000732146_200000210301 [0,1,0,0,0,1|1,0,0]=3 1324 B10R0.44 COC(=O)CC(C)CC(=O)[13CH3] 1458a_100000732146_200025704644 [0,1,0,0,0,1|1,0,0]=3 1325 B10R0.44 COC(=O)CC(C)OC(C)C 34a_100000212225_100009817358 [0,1,0,0,0,1|1,0,1]=4 1326 B10R0.44 COC(=O)C[C@@H](C)NC(=O)C 188690a_100016994721_100015343762 [0,1,0,0,0,1|1,0,0]=3 1327 B10R0.44 COC(C)SC(C)OC(=O)C 62a_100009818208_100009879195 [0,1,0,0,0,1|0,0,2]=4 1328 B10R0.44 COC(C)SC(C)OC(=O)C 62a_100009879195_100009818208 [0,1,0,0,0,1|0,0,2]=4 1329 B10R0.165 CC(=O)CC(C)(C)OC(C)C 7a_100000210262_100000210206 [0,1,0,0,0,1|1,0,1]=4 1330 B10R0.165 CC(=O)NC(C)(C)CC(=O)N 11a_100000763158_100015343762 [0,1,0,0,0,1|2,0,0]=4 1331 B10R0.165 CC(=O)NC(C)(C)CC(=O)N 1626a_100000763158_100015343762 [0,1,0,0,0,1|2,0,0]=4 1332 B10R0.165 CC(=O)NC(C)(C)CC(=O)N 240690a_100000763158_100015343762 [0,1,0,0,0,1|2,0,0]=4 1333 B10R0.165 CC(=O)NC(C)(C)CC(=O)N 527a_100000763158_100103153847 [0,1,0,0,0,1|2,0,0]=4 1334 B10R0.47 C#CC(C)OC(C)(C)C(=O)C 34a_100000747739_200000035995 [0,2,0,0,0,0|1,0,1]=4 1335 B10R0.47 C#C[C@@H](C)OC(C)(C)C(=O)C 7a_100009815206_100000075568 [0,2,0,0,0,0|1,0,1]=4 1336 B10R0.47 CC(=O)C(C)(C)OC(C)C#N 7a_100000747739_100000703298 [0,2,0,0,0,0|1,0,1]=4 1337 B10R0.47 CC(=O)C(C)(C)OC(C)CF 7a_100016041109_100000075568 [0,2,0,0,0,0|1,0,1]=4 1338 B10R0.47 CC(=O)C(C)(C)OC(C)CO 34a_100000747739_100012180447 [0,2,0,0,0,0|0,0,2]=4 1339 B10R0.47 CC(=O)C(C)(C)OC(C)CO 7a_100000747739_100012180447 [0,2,0,0,0,0|0,0,2]=4 1340 B10R0.47 CC(C)(NC(=O)CO)C(=O)N 240690a_100000743658_100000210174 [0,2,0,0,0,0|2,0,0]=4 1341 B10R0.47 CC(C)(NC(=O)CO)C(=O)N 527a_100000743658_100000210174 [0,2,0,0,0,0|2,0,0]=4 1342 B10R0.47 CCC(=O)NC(C)(C)C(=O)N 11a_100000743658_100000210414 [0,2,0,0,0,0|2,0,0]=4 1343 B10R0.47 CCC(=O)NC(C)(C)C(=O)N 240690a_100000743658_100000210414 [0,2,0,0,0,0|2,0,0]=4 1344 B10R0.47 CCC(=O)NC(C)(C)C(=O)N 527a_100000743658_100000210414 [0,2,0,0,0,0|2,0,0]=4 1345 B10R0.47 CCC(C)OC(C)(C)C(=O)C 34a_100000747739_100011215416 [0,2,0,0,0,0|1,0,1]=4 1346 B10R0.47 CCC(C)OC(C)(C)C(=O)C 7a_100000210228_100000075568 [0,2,0,0,0,0|1,0,1]=4 1347 B10R0.47 CCC(C)OC(C)(C)C(=O)C 7a_100000747739_100000758301 [0,2,0,0,0,0|1,0,1]=4 1348 B10R0.47 CNC(=O)NC(C)(C)C(=O)N 273464a_100102657272_100000743658 [0,2,0,0,0,0|2,0,0]=4 1349 B10R0.47 CNC(=O)NC(C)(C)C(=O)N 512a_100000743658_100102657272 [0,2,0,0,0,0|2,0,0]=4 1350 B10R0.47 CNC(=O)NC(C)(C)C(=O)N 512a_106832991638_100000743658 [0,2,0,0,0,0|2,0,0]=4 1351 B10R0.47 COC(=O)CC(C)(C)C(=O)C 1458a_100000720384_200000210301 [0,2,0,0,0,0|1,0,0]=3 1352 B10R0.47 COC(=O)CC(C)(C)C(=O)[13CH3] 1458a_100000720384_200025704644 [0,2,0,0,0,0|1,0,0]=3 1353 B10R0.141 CC(=O)NC(C)(C)C(=O)CF 1458a_100000750020_100015361967 [0,2,0,0,0,0|1,0,0]=3 1354 B10R0.141 CC(=O)OC(C)(C)C(=O)CF 1458a_200000137501_100015361967 [0,2,0,0,0,0|0,0,0]=2 1355 B10R0.141 CCC(=O)C(C)(C)NC(=O)C 1458a_100000750020_100000210202 [0,2,0,0,0,0|1,0,0]=3 1356 B10R0.141 CCC(=O)C(C)(C)OC(=O)C 1458a_200000137501_100000210202 [0,2,0,0,0,0|0,0,0]=2 1357 B10R0.141 CNC(=O)C(C)(C)NC(=O)C 11a_106832991635_100000750020 [0,2,0,0,0,0|1,0,0]=3 1358 B10R0.141 CNC(=O)C(C)(C)NC(=O)C 240690a_100102657272_100000750020 [0,2,0,0,0,0|1,0,0]=3 1359 B10R0.141 CNC(=O)C(C)(C)NC(=O)C 527a_100102657272_100000750020 [0,2,0,0,0,0|1,0,0]=3 1360 B10R0.141 CNC(=O)C(C)(C)OC(=O)C 1626a_100102657272_200000137501 [0,2,0,0,0,0|0,0,0]=2 1361 B10R0.141 CNC(=O)C(C)(C)OC(=O)C 240690a_100102657272_200000137501 [0,2,0,0,0,0|0,0,0]=2 1362 B10R0.141 CNC(=O)C(C)(C)OC(=O)C 527a_100102657272_200000137501 [0,2,0,0,0,0|0,0,0]=2 1363 B10R0.141 CNC(=O)C(C)(C)OC(C)C 34a_100000212225_100000732697 [0,2,0,0,0,0|1,0,1]=4 1364 B10R0.141 COC(=O)C(C)(C)CC(=O)C 1458a_100000106591_200000210301 [0,2,0,0,0,0|1,0,0]=3 1365 B10R0.141 COC(=O)C(C)(C)CC(=O)[13CH3] 1458a_100000106591_200025704644 [0,2,0,0,0,0|1,0,0]=3 1366 B10R0.141 COC(=O)C(C)(C)NC(=O)C 188690a_100000737553_100015343762 [0,2,0,0,0,0|1,0,0]=3 1367 B10R0.141 COC(=O)C(C)(C)OC(C)C 34a_100011217581_100000210206 [0,2,0,0,0,0|1,0,1]=4 1368 B10R0.141 COC(=O)C(C)(C)OC(C)C 7a_100011217581_100000210206 [0,2,0,0,0,0|1,0,1]=4 1369 B10R0.141 COC(=O)C(C)(F)OC(C)C 34a_100000212225_200009867631 [0,2,0,0,0,0|1,0,1]=4 1370 B10R0.163 CC(=O)C(C)(C)OC(C)(C)C 34a_100000747739_100000210625 [0,2,0,0,0,0|1,0,1]=4 1371 B10R0.163 CC(=O)C(C)(C)OC(C)(C)C 7a_100015890283_100000075568 [0,2,0,0,0,0|1,0,1]=4 1372 B10R0.32 C#CCC(=O)C(C)OC(=O)C 1458a_100011220946_100009818208 [0,2,0,0,0,0|0,0,0]=2 1373 B10R0.32 C#CCC(=O)[C@@H](C)NC(=O)C 1458a_100011504603_100000184674 [0,2,0,0,0,0|1,0,0]=3 1374 B10R0.32 C#CCC(=O)[C@H](C)OC(=O)C 1458a_100009816467_100000184674 [0,2,0,0,0,0|0,0,0]=2 1375 B10R0.32 C=CCC(=O)C(C)OC(=O)C 1458a_100000210193_100009818208 [0,2,0,0,0,0|0,0,0]=2 1376 B10R0.32 C=CCC(=O)[C@@H](C)NC(=O)C 1458a_100011504603_100000210623 [0,2,0,0,0,0|1,0,0]=3 1377 B10R0.32 C=CCC(=O)[C@H](C)OC(=O)C 1458a_100009816467_100000210623 [0,2,0,0,0,0|0,0,0]=2 1378 B10R0.32 C=CCN(C)C(C)OC(=O)C 269982a_100000225617_100009818208 [0,2,0,0,0,0|2,0,0]=4 1379 B10R0.32 CC#CC(=O)C(C)OC(=O)C 1458a_100000763181_100009818208 [0,2,0,0,0,0|0,0,0]=2 1380 B10R0.32 CC(=O)N[C@H](C)C(=O)CC#N 1458a_100011504603_100011214920 [0,2,0,0,0,0|1,0,0]=3 1381 B10R0.32 CC(=O)N[C@H](C)C(=O)CCF 1458a_100011504603_100011217306 [0,2,0,0,0,0|1,0,0]=3 1382 B10R0.32 CC(=O)N[C@H](C)C(=O)CCO 1458a_100011504603_100000211926 [0,2,0,0,0,0|1,0,0]=3 1383 B10R0.32 CC(=O)OC(C)C(=O)C=CBr 1458a_100016273825_100009818208 [0,2,0,0,0,0|0,0,1]=3 1384 B10R0.32 CC(=O)OC(C)C(=O)C=CCl 1458a_200016279998_100009818208 [0,2,0,0,0,0|0,0,1]=3 1385 B10R0.32 CC(=O)OC(C)C(=O)C=CI 1458a_100016256311_100009818208 [0,2,0,0,0,0|0,0,1]=3 1386 B10R0.32 CC(=O)OC(C)C(=O)CC#N 1458a_100051588842_100009818208 [0,2,0,0,0,0|0,0,0]=2 1387 B10R0.32 CC(=O)OC(C)C(=O)CCO 1458a_100011216618_100009818208 [0,2,0,0,0,0|0,0,0]=2 1388 B10R0.32 CC(=O)OC(C)N(C)CCO 269982a_100000210263_100009818208 [0,2,0,0,0,0|1,0,1]=4 1389 B10R0.32 CC(=O)O[C@@H](C)C(=O)CC#N 1458a_100009816467_100011214920 [0,2,0,0,0,0|0,0,0]=2 1390 B10R0.32 CC(=O)O[C@@H](C)C(=O)CCF 1458a_100009816467_100011217306 [0,2,0,0,0,0|0,0,0]=2 1391 B10R0.32 CC(=O)O[C@@H](C)C(=O)CCO 1458a_100009816467_100000211926 [0,2,0,0,0,0|0,0,0]=2 1392 B10R0.32 CC=CC(=O)C(C)OC(=O)C 1458a_100000210699_100009818208 [0,2,0,0,0,0|0,0,0]=2 1393 B10R0.32 CCCC(=O)C(C)OC(=O)C 1458a_100000211992_100009818208 [0,2,0,0,0,0|0,0,0]=2 1394 B10R0.32 CCCC(=O)[C@@H](C)NC(=O)C 1458a_100011504603_100000210303 [0,2,0,0,0,0|1,0,0]=3 1395 B10R0.32 CCCC(=O)[C@H](C)OC(=O)C 1458a_100009816467_100000210303 [0,2,0,0,0,0|0,0,0]=2 1396 B10R0.32 CCCN(C)C(C)OC(=O)C 269982a_100000747261_100009818208 [0,2,0,0,0,0|2,0,0]=4 1397 B10R0.32 CCNC(=O)C(C)NC(=O)C 11a_100000736553_100015343762 [0,2,0,0,0,0|1,0,0]=3 1398 B10R0.32 CCNC(=O)C(C)NC(=O)C 1626a_100000736553_100015343762 [0,2,0,0,0,0|1,0,0]=3 1399 B10R0.32 CCNC(=O)C(C)NC(=O)C 240690a_100000736553_100015343762 [0,2,0,0,0,0|1,0,0]=3 1400 B10R0.32 CCNC(=O)C(C)NC(=O)C 527a_100000736553_100103153847 [0,2,0,0,0,0|1,0,0]=3 1401 B10R0.32 CCNC(=O)C(C)OC(C)C 34a_100000212225_100000230173 [0,2,0,0,0,0|1,0,1]=4 1402 B10R0.32 CCNC(=O)[C@@H](C)NC(=O)C 11a_100015525214_100011504603 [0,2,0,0,0,0|1,0,0]=3 1403 B10R0.32 CCNC(=O)[C@@H](C)NC(=O)C 240690a_100015525214_100011504603 [0,2,0,0,0,0|1,0,0]=3 1404 B10R0.32 CCNC(=O)[C@@H](C)NC(=O)C 527a_100015525214_100011504603 [0,2,0,0,0,0|1,0,0]=3 1405 B10R0.32 CCNC(=O)[C@H](C)OC(=O)C 11a_100015525214_100009816467 [0,2,0,0,0,0|0,0,0]=2 1406 B10R0.32 CCNC(=O)[C@H](C)OC(=O)C 240690a_100015525214_100009816467 [0,2,0,0,0,0|0,0,0]=2 1407 B10R0.32 CCNC(=O)[C@H](C)OC(=O)C 527a_100015525214_100009816467 [0,2,0,0,0,0|0,0,0]=2 1408 B10R0.32 CCOC(=O)C(C)OC(C)C 34a_100000212225_100011216346 [0,2,0,0,0,0|1,0,1]=4 1409 B10R0.32 CCOC(=O)[C@@H](C)NC(=O)C 188690a_100016988386_100015343762 [0,2,0,0,0,0|1,0,0]=3 1410 B10R0.32 CCOC(=O)[C@H](C)OC(C)C 7a_100000751109_100000210206 [0,2,0,0,0,0|1,0,1]=4 1411 B10R0.32 CCSC(=O)[C@H](C)NC(=O)C 11a_100103168634_100015343762 [0,2,0,0,0,0|1,0,0]=3 1412 B10R0.32 CCSC(=O)[C@H](C)NC(=O)C 1626a_100103168634_100015343762 [0,2,0,0,0,0|1,0,0]=3 1413 B10R0.32 CCSC(=O)[C@H](C)NC(=O)C 240690a_100103168634_100015343762 [0,2,0,0,0,0|1,0,0]=3 1414 B10R0.32 CCSC(=O)[C@H](C)NC(=O)C 527a_100103168634_100103153847 [0,2,0,0,0,0|1,0,0]=3 1415 B10R0.32 CNNC(=O)[C@@H](C)NC(=O)C 22a_100016993582_100011504603 [0,2,0,0,0,0|1,0,0]=3 1416 B10R0.32 COCC(=O)C(C)OC(=O)C 1458a_100000210968_100009818208 [0,2,0,0,0,0|0,0,0]=2 1417 B10R0.32 CSCC(=O)C(C)OC(=O)C 1458a_100000184570_100009818208 [0,2,0,0,0,0|0,0,0]=2 1418 B10R0.37 CCC(=O)C(C)OC(C)(C)C 7a_100015890283_100000742827 [0,2,0,0,0,0|1,0,1]=4 1419 B10R0.37 CCC(=O)[C@H](C)OS(=O)(=O)C 1458a_200015292407_100000210202 [0,2,0,0,0,0|1,0,0]=3 1420 B10R0.37 CNC(=O)C(C)OC(C)(C)C 34a_100015890283_100000731044 [0,2,0,0,0,0|1,0,1]=4 1421 B10R0.37 CNC(=O)C(C)OC(C)(C)C 7a_100015890283_100000209862 [0,2,0,0,0,0|1,0,1]=4 1422 B10R0.37 CNC(=O)[C@@H](C)NS(=O)(=O)C 40a_100000684985_100000738038 [0,2,0,0,0,0|2,0,0]=4 1423 B10R0.37 CNC(=O)[C@H](C)OS(=O)(=O)C 11a_106832991635_200015292407 [0,2,0,0,0,0|1,0,0]=3 1424 B10R0.37 CNC(=O)[C@H](C)OS(=O)(=O)C 1626a_100102657272_200015292407 [0,2,0,0,0,0|1,0,0]=3 1425 B10R0.37 CNC(=O)[C@H](C)OS(=O)(=O)C 240690a_100102657272_200015292407 [0,2,0,0,0,0|1,0,0]=3 1426 B10R0.37 CNC(=O)[C@H](C)OS(=O)(=O)C 527a_100102657272_200015292407 [0,2,0,0,0,0|1,0,0]=3 1427 B10R0.37 COC(=O)C(C)OC(C)(C)C 34a_100011215400_100000210625 [0,2,0,0,0,0|1,0,1]=4 1428 B10R0.37 COC(=O)C(C)OC(C)(C)C 34a_100015890283_100000211248 [0,2,0,0,0,0|1,0,1]=4 1429 B10R0.37 COC(=O)C(C)OC(C)(C)C 7a_100015890283_100000211248 [0,2,0,0,0,0|1,0,1]=4 1430 B10R0.37 C[C@H](OS(=O)(=O)C)C(=O)CF 1458a_200015292407_100015361967 [0,2,0,0,0,0|1,0,0]=3 1431 B10R0.46 C#CC(C)OC(C)C(=O)OC 34a_100011215400_200000035995 [0,2,0,0,0,0|1,0,1]=4 1432 B10R0.46 C#C[C@@H](C)OC(C)C(=O)CC 7a_100009815206_100000742827 [0,2,0,0,0,0|1,0,1]=4 1433 B10R0.46 C#C[C@@H](C)OC(C)C(=O)NC 34a_100009815206_100000731044 [0,2,0,0,0,0|1,0,1]=4 1434 B10R0.46 C#C[C@@H](C)OC(C)C(=O)NC 7a_100009815206_100000209862 [0,2,0,0,0,0|1,0,1]=4 1435 B10R0.46 C#C[C@@H](C)OC(C)C(=O)OC 34a_100009815206_100000211248 [0,2,0,0,0,0|1,0,1]=4 1436 B10R0.46 C#C[C@@H](C)OC(C)C(=O)OC 7a_100009815206_100000211248 [0,2,0,0,0,0|1,0,1]=4 1437 B10R0.46 C=CC(=O)N[C@H](C)C(=O)NC 240690a_100000684985_200121576911 [0,2,0,0,0,0|1,0,1]=4 1438 B10R0.46 C=CC(C)OC(C)C(=O)NC 34a_100000695699_100000731044 [0,2,0,0,0,0|1,0,1]=4 1439 B10R0.46 C=CC(C)OC(C)C(=O)OC 34a_100000695699_100000211248 [0,2,0,0,0,0|1,0,1]=4 1440 B10R0.46 CCC(=O)C(C)CC(=O)OC 1458a_100000037256_100000210202 [0,2,0,0,0,0|1,0,0]=3 1441 B10R0.46 CCC(=O)C(C)OC(C)CC 7a_100000210228_100000742827 [0,2,0,0,0,0|1,0,1]=4 1442 B10R0.46 CCC(=O)C(C)OC(C)CF 7a_100016041109_100000742827 [0,2,0,0,0,0|1,0,1]=4 1443 B10R0.46 CCC(=O)N(C)CC(=O)NC 11a_100000189611_100000210414 [0,2,0,0,0,0|2,0,0]=4 1444 B10R0.46 CCC(=O)N(C)CC(=O)NC 240690a_100000189611_100000210414 [0,2,0,0,0,0|2,0,0]=4 1445 B10R0.46 CCC(=O)N(C)CC(=O)NC 527a_100000189611_100000210414 [0,2,0,0,0,0|2,0,0]=4 1446 B10R0.46 CCC(=O)N(C)CC(=O)OC 11a_100000198492_100000210414 [0,2,0,0,0,0|2,0,0]=4 1447 B10R0.46 CCC(=O)N(C)CC(=O)OC 1626a_100000198492_100000210414 [0,2,0,0,0,0|2,0,0]=4 1448 B10R0.46 CCC(=O)N(C)CC(=O)OC 240690a_100000198492_100000210414 [0,2,0,0,0,0|2,0,0]=4 1449 B10R0.46 CCC(=O)N(C)CC(=O)OC 527a_100000198492_100000210414 [0,2,0,0,0,0|2,0,0]=4 1450 B10R0.46 CCC(=O)NC(C)C(=O)CC 1458a_100000194823_100000210202 [0,2,0,0,0,0|1,0,0]=3 1451 B10R0.46 CCC(=O)NC(C)C(=O)CF 1458a_100000194823_100015361967 [0,2,0,0,0,0|1,0,0]=3 1452 B10R0.46 CCC(=O)NC(C)C(=O)NC 11a_106832991635_100000194823 [0,2,0,0,0,0|1,0,0]=3 1453 B10R0.46 CCC(=O)NC(C)C(=O)NC 1626a_100102657272_100000194823 [0,2,0,0,0,0|1,0,0]=3 1454 B10R0.46 CCC(=O)NC(C)C(=O)NC 240690a_100102657272_100000194823 [0,2,0,0,0,0|1,0,0]=3 1455 B10R0.46 CCC(=O)NC(C)C(=O)NC 527a_100102657272_100000194823 [0,2,0,0,0,0|1,0,0]=3 1456 B10R0.46 CCC(=O)N[C@H](C)C(=O)NC 11a_100000684985_100000210414 [0,2,0,0,0,0|1,0,0]=3 1457 B10R0.46 CCC(=O)N[C@H](C)C(=O)NC 240690a_100000684985_100000210414 [0,2,0,0,0,0|1,0,0]=3 1458 B10R0.46 CCC(=O)N[C@H](C)C(=O)NC 527a_100000684985_100000210414 [0,2,0,0,0,0|1,0,0]=3 1459 B10R0.46 CCC(=O)N[C@H](C)C(=O)OC 188690a_100000687819_100000210414 [0,2,0,0,0,0|1,0,0]=3 1460 B10R0.46 CCC(C)OC(C)C(=O)NC 7a_100000210228_100000209862 [0,2,0,0,0,0|1,0,1]=4 1461 B10R0.46 CCC(C)OC(C)C(=O)OC 34a_100011215400_100011215416 [0,2,0,0,0,0|1,0,1]=4 1462 B10R0.46 CCC(C)OC(C)C(=O)OC 7a_100000210228_100000211248 [0,2,0,0,0,0|1,0,1]=4 1463 B10R0.46 CNC(=O)C(C)CC(=O)OC 1626a_100102657272_100000037256 [0,2,0,0,0,0|1,0,0]=3 1464 B10R0.46 CNC(=O)C(C)CC(=O)OC 240690a_100102657272_100000037256 [0,2,0,0,0,0|1,0,0]=3 1465 B10R0.46 CNC(=O)C(C)CC(=O)OC 527a_100102657272_100000037256 [0,2,0,0,0,0|1,0,0]=3 1466 B10R0.46 CNC(=O)C(C)OC(C)C#N 34a_100011218135_100000731044 [0,2,0,0,0,0|1,0,1]=4 1467 B10R0.46 CNC(=O)C(C)OC(C)CF 34a_100016041109_100000731044 [0,2,0,0,0,0|1,0,1]=4 1468 B10R0.46 CNC(=O)C(C)OC(C)CF 7a_100016041109_100000209862 [0,2,0,0,0,0|1,0,1]=4 1469 B10R0.46 CNC(=O)C(C)OC(C)CN 34a_100000210904_100000731044 [0,2,0,0,0,0|1,0,1]=4 1470 B10R0.46 CNC(=O)CN(C)C(=O)CO 240690a_100000189611_100000210174 [0,2,0,0,0,0|2,0,0]=4 1471 B10R0.46 CNC(=O)CN(C)C(=O)CO 527a_100000189611_100000210174 [0,2,0,0,0,0|2,0,0]=4 1472 B10R0.46 CNC(=O)CN(C)C(=O)NC 2708a_100102657272_100000189611 [0,2,0,0,0,0|2,0,0]=4 1473 B10R0.46 CNC(=O)N[C@H](C)C(=O)NC 2708a_100102657272_100000684985 [0,2,0,0,0,0|1,0,0]=3 1474 B10R0.46 CNC(=O)N[C@H](C)C(=O)NC 273464a_100000684985_100102657272 [0,2,0,0,0,0|1,0,0]=3 1475 B10R0.46 CNC(=O)N[C@H](C)C(=O)NC 512a_100000684985_100102657272 [0,2,0,0,0,0|1,0,0]=3 1476 B10R0.46 CNC(=O)N[C@H](C)C(=O)NC 512a_106832991638_100000684985 [0,2,0,0,0,0|1,0,0]=3 1477 B10R0.46 CNC(=O)[C@@H](C)NC(=O)CO 240690a_100000684985_100000210174 [0,2,0,0,0,0|1,0,0]=3 1478 B10R0.46 CNC(=O)[C@@H](C)NC(=O)CO 527a_100000684985_100000210174 [0,2,0,0,0,0|1,0,0]=3 1479 B10R0.46 COC(=O)C(C)OC(C)C#N 34a_100011218135_100000211248 [0,2,0,0,0,0|1,0,1]=4 1480 B10R0.46 COC(=O)C(C)OC(C)CF 34a_100016041109_100000211248 [0,2,0,0,0,0|1,0,1]=4 1481 B10R0.46 COC(=O)C(C)OC(C)CF 7a_100016041109_100000211248 [0,2,0,0,0,0|1,0,1]=4 1482 B10R0.46 COC(=O)C(C)OC(C)CN 34a_100000210904_100000211248 [0,2,0,0,0,0|1,0,1]=4 1483 B10R0.46 COC(=O)C(C)OC(C)CO 34a_100011215400_100012180447 [0,2,0,0,0,0|0,0,2]=4 1484 B10R0.46 COC(=O)CC(C)C(=O)CF 1458a_100000037256_100015361967 [0,2,0,0,0,0|1,0,0]=3 1485 B10R0.46 COC(=O)CN(C)C(=O)CO 240690a_100000198492_100000210174 [0,2,0,0,0,0|2,0,0]=4 1486 B10R0.46 COC(=O)CN(C)C(=O)CO 527a_100000198492_100000210174 [0,2,0,0,0,0|2,0,0]=4 1487 B10R0.46 COC(=O)[C@@H](C)NC(=O)CO 188690a_100000687819_100000210174 [0,2,0,0,0,0|1,0,0]=3 1488 B10R0.54 CC(=O)NC(CO)C(=O)CF 1458a_200011194110_100015361967 [0,2,0,0,0,0|1,0,0]=3 1489 B10R0.54 CCC(=O)C(CC)NC(=O)C 1458a_100000195128_100000210202 [0,2,0,0,0,0|1,0,0]=3 1490 B10R0.54 CCC(=O)C(CC)NC(=O)N 1458a_100000203762_100000210202 [0,2,0,0,0,0|2,0,0]=4 1491 B10R0.54 CCC(=O)C(CC)OC(C)C 34a_200011218131_100000210206 [0,2,0,0,0,0|1,0,1]=4 1492 B10R0.54 CCC(=O)C(CC)OC(C)C 7a_200011218131_100000210206 [0,2,0,0,0,0|1,0,1]=4 1493 B10R0.54 CCC(=O)C(CO)NC(=O)C 1458a_200011194110_100000210202 [0,2,0,0,0,0|1,0,0]=3 1494 B10R0.54 CCC(NC(=O)C)C(=O)CF 1458a_100000195128_100015361967 [0,2,0,0,0,0|1,0,0]=3 1495 B10R0.54 CCC(NC(=O)C)C(=O)NC 11a_106832991635_100000195128 [0,2,0,0,0,0|1,0,0]=3 1496 B10R0.54 CCC(NC(=O)C)C(=O)NC 1626a_100102657272_100000195128 [0,2,0,0,0,0|1,0,0]=3 1497 B10R0.54 CCC(NC(=O)C)C(=O)NC 240690a_100102657272_100000195128 [0,2,0,0,0,0|1,0,0]=3 1498 B10R0.54 CCC(NC(=O)C)C(=O)NC 527a_100102657272_100000195128 [0,2,0,0,0,0|1,0,0]=3 1499 B10R0.54 CCC(NC(=O)N)C(=O)CF 1458a_100000203762_100015361967 [0,2,0,0,0,0|2,0,0]=4 1500 B10R0.54 CCC(NC(=O)N)C(=O)NC 240690a_100102657272_100000203762 [0,2,0,0,0,0|2,0,0]=4 1501 B10R0.54 CCC(OC(C)C)C(=O)OC 34a_100000212225_100000235869 [0,2,0,0,0,0|1,0,1]=4 1502 B10R0.54 CCC(OC(C)C)C(=O)OC 34a_100000695916_100000210206 [0,2,0,0,0,0|1,0,1]=4 1503 B10R0.54 CCC(OC(C)C)C(=O)OC 7a_100000695916_100000210206 [0,2,0,0,0,0|1,0,1]=4 1504 B10R0.54 CC[C@@H](NC(=O)C)C(=O)OC 188690a_100020627782_100015343762 [0,2,0,0,0,0|1,0,0]=3 1505 B10R0.54 CC[C@H](NC(=O)C)C(=O)NC 11a_106657271573_100015343762 [0,2,0,0,0,0|1,0,0]=3 1506 B10R0.54 CC[C@H](NC(=O)C)C(=O)NC 1626a_106657271573_100015343762 [0,2,0,0,0,0|1,0,0]=3 1507 B10R0.54 CC[C@H](NC(=O)C)C(=O)NC 240690a_106657271573_100015343762 [0,2,0,0,0,0|1,0,0]=3 1508 B10R0.54 CC[C@H](NC(=O)C)C(=O)NC 527a_106657271573_100103153847 [0,2,0,0,0,0|1,0,0]=3 1509 B10R0.54 CNC(=O)C(CO)NC(=O)C 240690a_100102657272_200011194110 [0,2,0,0,0,0|1,0,0]=3 1510 B10R0.54 COC(=O)C(CN)OC(C)C 34a_100000695228_100000210206 [0,2,0,0,0,0|1,0,1]=4 1511 B10R0.54 COC(=O)C(CO)OC(C)C 34a_100000212225_100012276630 [0,2,0,0,0,0|1,0,1]=4 1512 B10R0.54 COC(=O)C(OC)OC(C)C 34a_100000036821_100000210206 [0,2,0,0,0,0|1,0,1]=4 1513 B10R0.54 COC(=O)C(OC)OC(C)C 34a_100000212225_100000101307 [0,2,0,0,0,0|1,0,1]=4 1514 B10R0.54 COC(=O)[C@@H](CO)NC(=O)C 188690a_100000003586_100015343762 [0,2,0,0,0,0|1,0,0]=3 1515 B10R0.56 C/C=C(\C)/C(=O)C(C)C(=O)C 1458a_100020587367_100000179758 [0,2,0,0,0,0|2,0,0]=4 1516 B10R0.56 C=C(C)C(=O)C(C)C(=O)CC 1458a_100000185857_100000742827 [0,2,0,0,0,0|2,0,0]=4 1517 B10R0.56 C=C(C)C(=O)C(C)C(=O)NC 1458a_100000185857_100000209862 [0,2,0,0,0,0|2,0,0]=4 1518 B10R0.56 C=C(C)C(=O)C(C)C(=O)OC 1458a_100000185857_100000211248 [0,2,0,0,0,0|2,0,0]=4 1519 B10R0.56 CNC(=O)C(=O)C(C)C(=O)C 1458a_100011218921_100000179758 [0,2,0,0,0,0|1,0,0]=3 1520 B10R0.56 CNC(=O)C(=O)C(C)C(=O)N 1458a_100011218921_100000702099 [0,2,0,0,0,0|2,0,0]=4 1521 B10R0.56 COC(=O)C(C)N(C)C(=O)C 11a_100000725243_100015343762 [0,2,0,0,0,0|1,0,0]=3 1522 B10R0.56 COC(=O)C(C)N(C)C(=O)C 240690a_100000725243_100015343762 [0,2,0,0,0,0|1,0,0]=3 1523 B10R0.56 COC(=O)C(C)N(C)C(=O)C 527a_100000725243_100103153847 [0,2,0,0,0,0|1,0,0]=3 1524 B10R0.56 COC(=O)N(C)[C@H](C)C(=O)C 1458a_200021015837_200000210301 [0,2,0,0,0,0|1,0,0]=3 1525 B10R0.56 COC(=O)N(C)[C@H](C)C(=O)[13CH3] 1458a_200021015837_200025704644 [0,2,0,0,0,0|1,0,0]=3 1526 B10R0.144 CCN(CC)C(C)OC(=O)C 269956a_100000042499_100009818208 [0,2,0,0,0,0|2,0,0]=4 1527 B10R0.144 CCN(CC)C(C)OC(=O)C 269982a_100000724800_100009818208 [0,2,0,0,0,0|2,0,0]=4 1528 B10R0.23 C=CCC(NC(=O)C)C(=O)C 1458a_100000741017_200000210301 [0,2,0,0,0,0|1,0,0]=3 1529 B10R0.23 C=CCC(NC(=O)C)C(=O)[13CH3] 1458a_100000741017_200025704644 [0,2,0,0,0,0|1,0,0]=3 1530 B10R0.23 CCC[C@H](NC(=O)C)C(=O)C 1458a_100011995990_200000210301 [0,2,0,0,0,0|1,0,0]=3 1531 B10R0.23 CCC[C@H](NC(=O)C)C(=O)N 11a_100000729256_100015343762 [0,2,0,0,0,0|2,0,0]=4 1532 B10R0.23 CCC[C@H](NC(=O)C)C(=O)N 1626a_100000729256_100015343762 [0,2,0,0,0,0|2,0,0]=4 1533 B10R0.23 CCC[C@H](NC(=O)C)C(=O)N 240690a_100000729256_100015343762 [0,2,0,0,0,0|2,0,0]=4 1534 B10R0.23 CCC[C@H](NC(=O)C)C(=O)N 527a_100000729256_100103153847 [0,2,0,0,0,0|2,0,0]=4 1535 B10R0.23 CCC[C@H](NC(=O)C)C(=O)[13CH3] 1458a_100011995990_200025704644 [0,2,0,0,0,0|1,0,0]=3 1536 B10R0.23 COCC(NC(=O)C)C(=O)C 1458a_200012277492_200000210301 [0,2,0,0,0,0|1,0,0]=3 1537 B10R0.23 COCC(NC(=O)C)C(=O)[13CH3] 1458a_200012277492_200025704644 [0,2,0,0,0,0|1,0,0]=3 1538 B10R0.53 CCC(=O)NC(CC)C(=O)N 11a_100000733705_100000210414 [0,2,0,0,0,0|2,0,0]=4 1539 B10R0.53 CCC(=O)NC(CC)C(=O)N 1626a_100000733705_100000210414 [0,2,0,0,0,0|2,0,0]=4 1540 B10R0.53 CCC(=O)NC(CC)C(=O)N 240690a_100000733705_100000210414 [0,2,0,0,0,0|2,0,0]=4 1541 B10R0.53 CCC(=O)NC(CC)C(=O)N 527a_100000733705_100000210414 [0,2,0,0,0,0|2,0,0]=4 1542 B10R0.53 CCC(=O)N[C@@H](CO)C(=O)N 240690a_100000729942_100000210414 [0,2,0,0,0,0|2,0,0]=4 1543 B10R0.53 CCC(=O)OC(NC)C(C)C 34a_100102657272_100016989192 [0,2,0,0,0,0|1,0,1]=4 1544 B10R0.53 CCC(=O)OC(NC)C(C)C 7a_106832991635_100016989192 [0,2,0,0,0,0|1,0,1]=4 1545 B10R0.53 CCC(=O)OC(OC)C(C)C 34a_100138415774_100016989192 [0,2,0,0,0,0|1,0,1]=4 1546 B10R0.53 CCC(=O)OC(SC)C(C)C 62a_100016989192_200000210301 [0,2,0,0,0,0|1,0,1]=4 1547 B10R0.53 CCC(=O)OC(SC)C(C)C 62a_200000210301_100016989192 [0,2,0,0,0,0|1,0,1]=4 1548 B10R0.53 CCC(=O)OC(S[13CH3])C(C)C 62a_100016989192_200025704644 [0,2,0,0,0,0|1,0,1]=4 1549 B10R0.53 CCC(=O)OC(S[13CH3])C(C)C 62a_200025704644_100016989192 [0,2,0,0,0,0|1,0,1]=4 1550 B10R0.53 CCC(NC(=O)CO)C(=O)N 240690a_100000733705_100000210174 [0,2,0,0,0,0|2,0,0]=4 1551 B10R0.53 CCC(NC(=O)CO)C(=O)N 527a_100000733705_100000210174 [0,2,0,0,0,0|2,0,0]=4 1552 B10R0.53 CCC(NC(=O)NC)C(=O)N 2708a_100102657272_100000733705 [0,2,0,0,0,0|2,0,0]=4 1553 B10R0.53 CCC(NC(=O)NC)C(=O)N 273464a_100000733705_100102657272 [0,2,0,0,0,0|2,0,0]=4 1554 B10R0.53 CCC(NC(=O)NC)C(=O)N 273464a_100102657272_100000733705 [0,2,0,0,0,0|2,0,0]=4 1555 B10R0.53 CCC(NC(=O)NC)C(=O)N 512a_100000733705_100102657272 [0,2,0,0,0,0|2,0,0]=4 1556 B10R0.53 CNC(=O)N[C@@H](CO)C(=O)N 273464a_100000729942_100102657272 [0,2,0,0,0,0|2,0,0]=4 1557 B10R0.53 CNC(=O)N[C@@H](CO)C(=O)N 273464a_100102657272_100000729942 [0,2,0,0,0,0|2,0,0]=4 1558 B10R0.53 NC(=O)[C@H](CO)NC(=O)CO 240690a_100000729942_100000210174 [0,2,0,0,0,0|2,0,0]=4 1559 B10R0.76 CCN(C(=O)C)C(C)C(=O)N 11a_100020603310_100015343762 [0,2,0,0,0,0|2,0,0]=4 1560 B10R0.76 CCN(C(=O)C)C(C)C(=O)N 1626a_100020603310_100015343762 [0,2,0,0,0,0|2,0,0]=4 1561 B10R0.76 CCN(C(=O)C)C(C)C(=O)N 240690a_100020603310_100015343762 [0,2,0,0,0,0|2,0,0]=4 1562 B10R0.76 CCN(C(=O)C)C(C)C(=O)N 527a_100020603310_100103153847 [0,2,0,0,0,0|2,0,0]=4 1563 B10R0.76 CC[C@@H](C(=O)N)N(C)C(=O)C 11a_103436537554_100015343762 [0,2,0,0,0,0|2,0,0]=4 1564 B10R0.76 CC[C@@H](C(=O)N)N(C)C(=O)C 1626a_103436537554_100015343762 [0,2,0,0,0,0|2,0,0]=4 1565 B10R0.76 CC[C@@H](C(=O)N)N(C)C(=O)C 240690a_103436537554_100015343762 [0,2,0,0,0,0|2,0,0]=4 1566 B10R0.76 CC[C@@H](C(=O)N)N(C)C(=O)C 527a_103436537554_100103153847 [0,2,0,0,0,0|2,0,0]=4 1567 B10R0.162 CC(=O)N[C@H](C(=O)C)C(C)C 1458a_100011416799_200000210301 [0,2,0,0,0,0|1,0,0]=3 1568 B10R0.162 CC(=O)N[C@H](C(=O)C)[C@@H](C)O 1458a_100012017110_200000210301 [0,2,0,0,0,0|1,0,0]=3 1569 B10R0.162 CC(=O)N[C@H](C(=O)N)C(C)C 11a_100000119348_100015343762 [0,2,0,0,0,0|2,0,0]=4 1570 B10R0.162 CC(=O)N[C@H](C(=O)N)C(C)C 1626a_100000119348_100015343762 [0,2,0,0,0,0|2,0,0]=4 1571 B10R0.162 CC(=O)N[C@H](C(=O)N)C(C)C 240690a_100000119348_100015343762 [0,2,0,0,0,0|2,0,0]=4 1572 B10R0.162 CC(=O)N[C@H](C(=O)N)C(C)C 527a_100000119348_100103153847 [0,2,0,0,0,0|2,0,0]=4 1573 B10R0.162 CC(=O)N[C@H](C(=O)N)[C@@H](C)O 11a_100000003557_100015343762 [0,2,0,0,0,0|2,0,0]=4 1574 B10R0.162 CC(=O)N[C@H](C(=O)N)[C@@H](C)O 240690a_100000003557_100015343762 [0,2,0,0,0,0|2,0,0]=4 1575 B10R0.162 CC(=O)N[C@H](C(=O)N)[C@@H](C)O 527a_100000003557_100103153847 [0,2,0,0,0,0|2,0,0]=4 1576 B10R0.162 CC(=O)N[C@H](C(=O)[13CH3])C(C)C 1458a_100011416799_200025704644 [0,2,0,0,0,0|1,0,0]=3 1577 B10R0.162 CC(=O)N[C@H](C(=O)[13CH3])[C@@H](C)O 1458a_100012017110_200025704644 [0,2,0,0,0,0|1,0,0]=3 1578 B10R0.162 CC(=O)O[C@@H](C(=O)C)C(C)C 1458a_100016231877_200000210301 [0,2,0,0,0,0|0,0,0]=2 1579 B10R0.162 CC(=O)O[C@@H](C(=O)[13CH3])C(C)C 1458a_100016231877_200025704644 [0,2,0,0,0,0|0,0,0]=2 1580 B10R0.26 C#CCC(=O)CN(C)C(=O)C 1458a_100000194957_100000184674 [0,2,0,0,0,0|2,0,0]=4 1581 B10R0.26 C#CCC(=O)N[C@H](C)C(=O)N 527a_100000119354_100011220946 [0,2,0,0,0,0|2,0,0]=4 1582 B10R0.26 C#CCC(C)OC(C)C(=O)C 7a_100000685586_100000179758 [0,2,0,0,0,0|1,0,1]=4 1583 B10R0.26 C=CCC(=O)CN(C)C(=O)C 1458a_100000194957_100000210623 [0,2,0,0,0,0|2,0,0]=4 1584 B10R0.26 C=CCC(=O)N[C@H](C)C(=O)N 11a_100000119354_100000210193 [0,2,0,0,0,0|2,0,0]=4 1585 B10R0.26 C=CCC(=O)N[C@H](C)C(=O)N 240690a_100000119354_100000210193 [0,2,0,0,0,0|2,0,0]=4 1586 B10R0.26 C=CCC(=O)N[C@H](C)C(=O)N 527a_100000119354_100000210193 [0,2,0,0,0,0|2,0,0]=4 1587 B10R0.26 C=CC[C@@H](C)OC(C)C(=O)C 7a_100000731007_100000179758 [0,2,0,0,0,0|1,0,1]=4 1588 B10R0.26 CC(=O)C(C)OC(C)CCO 34a_100000212229_100009893172 [0,2,0,0,0,0|0,0,2]=4 1589 B10R0.26 CC(=O)N(C)CC(=O)CC#N 1458a_100000194957_100011214920 [0,2,0,0,0,0|2,0,0]=4 1590 B10R0.26 CC(=O)N(C)CC(=O)CCF 1458a_100000194957_100011217306 [0,2,0,0,0,0|2,0,0]=4 1591 B10R0.26 CC(=O)N(C)CC(=O)CCO 1458a_100000194957_100000211926 [0,2,0,0,0,0|2,0,0]=4 1592 B10R0.26 CC=CC(=O)N[C@H](C)C(=O)N 11a_100000119354_100000210699 [0,2,0,0,0,0|2,0,0]=4 1593 B10R0.26 CC=CC(=O)N[C@H](C)C(=O)N 240690a_100000119354_100000210699 [0,2,0,0,0,0|2,0,0]=4 1594 B10R0.26 CCCC(=O)CN(C)C(=O)C 1458a_100000194957_100000210303 [0,2,0,0,0,0|2,0,0]=4 1595 B10R0.26 CCCC(=O)NC(C)C(=O)C 1458a_100000205598_200000210301 [0,2,0,0,0,0|1,0,0]=3 1596 B10R0.26 CCCC(=O)NC(C)C(=O)[13CH3] 1458a_100000205598_200025704644 [0,2,0,0,0,0|1,0,0]=3 1597 B10R0.26 CCCC(=O)N[C@H](C)C(=O)N 11a_100000119354_100000211992 [0,2,0,0,0,0|2,0,0]=4 1598 B10R0.26 CCCC(=O)N[C@H](C)C(=O)N 240690a_100000119354_100000211992 [0,2,0,0,0,0|2,0,0]=4 1599 B10R0.26 CCCC(=O)N[C@H](C)C(=O)N 527a_100000119354_100000211992 [0,2,0,0,0,0|2,0,0]=4 1600 B10R0.26 CCCC(C)OC(C)C(=O)C 34a_100000212229_100000766640 [0,2,0,0,0,0|1,0,1]=4 1601 B10R0.26 CCCC(C)OC(C)C(=O)C 7a_100000764384_100000179758 [0,2,0,0,0,0|1,0,1]=4 1602 B10R0.26 CCNC(=O)CN(C)C(=O)C 11a_100000741943_100015343762 [0,2,0,0,0,0|2,0,0]=4 1603 B10R0.26 CCNC(=O)CN(C)C(=O)C 11a_100015525214_100000194957 [0,2,0,0,0,0|2,0,0]=4 1604 B10R0.26 CCNC(=O)CN(C)C(=O)C 1626a_100000741943_100015343762 [0,2,0,0,0,0|2,0,0]=4 1605 B10R0.26 CCNC(=O)CN(C)C(=O)C 240690a_100000741943_100015343762 [0,2,0,0,0,0|2,0,0]=4 1606 B10R0.26 CCNC(=O)CN(C)C(=O)C 240690a_100015525214_100000194957 [0,2,0,0,0,0|2,0,0]=4 1607 B10R0.26 CCNC(=O)CN(C)C(=O)C 527a_100000741943_100103153847 [0,2,0,0,0,0|2,0,0]=4 1608 B10R0.26 CCNC(=O)CN(C)C(=O)C 527a_100015525214_100000194957 [0,2,0,0,0,0|2,0,0]=4 1609 B10R0.26 CCNC(=O)N[C@H](C)C(=O)N 273464a_100000119354_100015525214 [0,2,0,0,0,0|2,0,0]=4 1610 B10R0.26 CCNC(=O)N[C@H](C)C(=O)N 273464a_100015525214_100000119354 [0,2,0,0,0,0|2,0,0]=4 1611 B10R0.26 CCNC(=O)N[C@H](C)C(=O)N 512a_100000119354_100015525214 [0,2,0,0,0,0|2,0,0]=4 1612 B10R0.26 CCNC(=O)N[C@H](C)C(=O)N 512a_100015525214_100000119354 [0,2,0,0,0,0|2,0,0]=4 1613 B10R0.26 CCOC(=O)CC(C)C(=O)C 1458a_100000070787_100009817359 [0,2,0,0,0,0|1,0,0]=3 1614 B10R0.26 CCOC(=O)CN(C)C(=O)C 11a_100000220588_100015343762 [0,2,0,0,0,0|2,0,0]=4 1615 B10R0.26 CCOC(=O)CN(C)C(=O)C 1626a_100000220588_100015343762 [0,2,0,0,0,0|2,0,0]=4 1616 B10R0.26 CCOC(=O)CN(C)C(=O)C 240690a_100000220588_100015343762 [0,2,0,0,0,0|2,0,0]=4 1617 B10R0.26 CCOC(=O)CN(C)C(=O)C 527a_100000220588_100103153847 [0,2,0,0,0,0|2,0,0]=4 1618 B10R0.26 CCOC(=O)OC(C)N(C)C 269982a_100102631434_100000036008 [0,2,0,0,0,0|2,0,0]=4 1619 B10R0.26 CNCC(=O)N[C@@H](C)C(=O)O 269956a_100011417567_200000210301 [0,2,0,0,0,0|2,0,0]=4 1620 B10R0.26 CNNC(=O)CN(C)C(=O)C 22a_100016993582_100000194957 [0,2,0,0,0,0|2,0,0]=4 1621 B10R0.26 CNNC(=O)N[C@H](C)C(=O)N 273464a_100000119354_100016993582 [0,2,0,0,0,0|2,0,0]=4 1622 B10R0.26 CNNC(=O)N[C@H](C)C(=O)N 512a_100000119354_100016993582 [0,2,0,0,0,0|2,0,0]=4 1623 B10R0.26 CNNC(=O)N[C@H](C)C(=O)N 512a_100016993582_100000119354 [0,2,0,0,0,0|2,0,0]=4 1624 B10R0.26 COCC(=O)N[C@H](C)C(=O)N 11a_100000119354_100000210968 [0,2,0,0,0,0|2,0,0]=4 1625 B10R0.26 COCC(=O)N[C@H](C)C(=O)N 240690a_100000119354_100000210968 [0,2,0,0,0,0|2,0,0]=4 1626 B10R0.26 COCC(=O)N[C@H](C)C(=O)N 527a_100000119354_100000210968 [0,2,0,0,0,0|2,0,0]=4 1627 B10R0.26 COCC(C)OC(C)C(=O)C 34a_100000212229_100000765312 [0,2,0,0,0,0|0,0,2]=4 1628 B10R0.26 CSCC(=O)N[C@H](C)C(=O)N 11a_100000119354_100000184570 [0,2,0,0,0,0|2,0,0]=4 1629 B10R0.26 CSCC(=O)N[C@H](C)C(=O)N 240690a_100000119354_100000184570 [0,2,0,0,0,0|2,0,0]=4 1630 B10R0.26 CSCC(=O)N[C@H](C)C(=O)N 527a_100000119354_100000184570 [0,2,0,0,0,0|2,0,0]=4 1631 B10R0.26 C[C@@H](NC(=O)CC#N)C(=O)N 240690a_100000119354_100051588842 [0,2,0,0,0,0|2,0,0]=4 1632 B10R0.26 C[C@@H](NC(=O)CCO)C(=O)N 240690a_100000119354_100011216618 [0,2,0,0,0,0|2,0,0]=4 1633 B10R0.26 C[C@H](NC(=O)CN[13CH3])C(=O)O 269956a_100011417567_200025704644 [0,2,0,0,0,0|2,0,0]=4 1634 B10R0.67 C#CC(C)(C)OC(C)C(=O)C 34a_100000212229_100000038118 [0,2,0,0,0,0|1,0,1]=4 1635 B10R0.67 C#CC(C)(C)OC(C)C(=O)C 7a_100000189450_100000179758 [0,2,0,0,0,0|1,0,1]=4 1636 B10R0.67 C=CC(C)(C)OC(C)C(=O)C 7a_100011215311_100000179758 [0,2,0,0,0,0|1,0,1]=4 1637 B10R0.67 CC(=O)C(C)OC(C)(C)C#N 34a_100000212229_100011162410 [0,2,0,0,0,0|1,0,1]=4 1638 B10R0.67 CC(=O)C(C)OC(C)(C)CCl 7a_100000764493_100000179758 [0,2,0,0,0,0|1,0,1]=4 1639 B10R0.67 CCC(C)(C)OC(C)C(=O)C 7a_100000210230_100000179758 [0,2,0,0,0,0|1,0,1]=4 1640 B10R0.72 C#CC(CC)OC(C)C(=O)C 7a_100000758843_100000179758 [0,2,0,0,0,0|1,0,1]=4 1641 B10R0.72 C=CC(CC)OC(C)C(=O)C 7a_100000766422_100000179758 [0,2,0,0,0,0|1,0,1]=4 1642 B10R0.72 CC(=O)C(C)OC(C=O)C=O 34a_100000212229_100000736813 [0,2,0,0,0,0|0,0,2]=4 1643 B10R0.72 CC(=O)C(C)OC(CCl)CCl 7a_100000737055_100000179758 [0,2,0,0,0,0|1,0,1]=4 1644 B10R0.72 CC(=O)C(C)OC(CF)CF 7a_100000032261_100000179758 [0,2,0,0,0,0|1,0,1]=4 1645 B10R0.72 CC(=O)C(C)O[C@@H](CF)CCl 7a_100015614560_100000179758 [0,2,0,0,0,0|1,0,1]=4 1646 B10R0.72 CCC(CC)OC(C)C(=O)C 7a_100000688536_100000179758 [0,2,0,0,0,0|1,0,1]=4 1647 B8R1.1 CNC1COC(=O)O1 34a_100102657272_100000032252 [1,0,0,1,0,0|2,0,0]=4 1648 B8R1.1 COC1CCC(=O)C1 34a_100012614533_200000210301 [1,0,0,1,0,0|2,0,0]=4 1649 B8R1.1 COC1COC(=O)O1 34a_100138415774_100000032252 [1,0,0,1,0,0|2,0,0]=4 1650 B8R1.1 CSC1COC(=O)O1 62a_200000210301_100000032252 [1,0,0,1,0,0|2,0,0]=4 1651 B8R1.1 [13CH3]OC1CCC(=O)C1 34a_100012614533_200025704644 [1,0,0,1,0,0|2,0,0]=4 1652 B8R1.1 [13CH3]SC1COC(=O)O1 62a_200025704644_100000032252 [1,0,0,1,0,0|2,0,0]=4 1653 B8R1.31 CC(=O)N1CCC1C 11a_100000755817_100015343762 [1,0,0,1,0,0|1,0,1]=4 1654 B8R1.31 CC(=O)N1CCC1C 240690a_100000755817_100015343762 [1,0,0,1,0,0|1,0,1]=4 1655 B8R1.31 CC(=O)N1CCC1C 527a_100000755817_100103153847 [1,0,0,1,0,0|1,0,1]=4 1656 B8R1.34 CC(=O)CC1CCC1 1458a_100000070787_100000763275 [1,0,0,1,0,0|1,0,1]=4 1657 B8R1.34 CC(=O)CC1CCC1 1458a_100000763092_200000210301 [1,0,0,1,0,0|1,0,1]=4 1658 B8R1.34 CC(=O)CC1CCO1 1458a_100000070787_100000103362 [1,0,0,1,0,0|2,0,0]=4 1659 B8R1.34 CC(=O)NC1CCC1 11a_100000749019_100015343762 [1,0,0,1,0,0|1,0,1]=4 1660 B8R1.34 CC(=O)NC1CCC1 1626a_100000749019_100015343762 [1,0,0,1,0,0|1,0,1]=4 1661 B8R1.34 CC(=O)NC1CCC1 240690a_100000749019_100015343762 [1,0,0,1,0,0|1,0,1]=4 1662 B8R1.34 CC(=O)NC1CCC1 527a_100000749019_100103153847 [1,0,0,1,0,0|1,0,1]=4 1663 B8R1.34 [13CH3]C(=O)CC1CCC1 1458a_100000763092_200025704644 [1,0,0,1,0,0|1,0,1]=4 1664 B8R1.42 CC(=O)CC1(CC1)C 1458a_100000112800_200000210301 [1,0,0,1,0,0|1,0,1]=4 1665 B8R1.42 CC(=O)CC1(CO1)C 1458a_100000070787_100000760498 [1,0,0,1,0,0|2,0,0]=4 1666 B8R1.42 CC(=O)NC1(CC1)C 11a_100000757604_100015343762 [1,0,0,1,0,0|1,0,1]=4 1667 B8R1.42 CC(=O)NC1(CC1)C 1626a_100000757604_100015343762 [1,0,0,1,0,0|1,0,1]=4 1668 B8R1.42 CC(=O)NC1(CC1)C 240690a_100000757604_100015343762 [1,0,0,1,0,0|1,0,1]=4 1669 B8R1.42 CC(=O)NC1(CC1)C 527a_100000757604_100103153847 [1,0,0,1,0,0|1,0,1]=4 1670 B8R1.42 CC1(CC1)CC(=O)[13CH3] 1458a_100000112800_200025704644 [1,0,0,1,0,0|1,0,1]=4 1671 B8R1.43 CCC1CC1C(=O)C 1458a_200011661523_200000210301 [1,0,0,1,0,0|1,0,1]=4 1672 B8R1.43 CCC1CC1C(=O)[13CH3] 1458a_200011661523_200025704644 [1,0,0,1,0,0|1,0,1]=4 1673 B8R1.7 CC(=O)C1CC=CC1 1458a_100000759439_200000210301 [1,0,0,1,0,0|1,0,1]=4 1674 B8R1.7 CC(=O)C1CCCC1 1458a_100000070787_100000179811 [1,0,0,1,0,0|1,0,1]=4 1675 B8R1.7 CC(=O)C1CCCC1 1458a_100000210718_200000210301 [1,0,0,1,0,0|1,0,1]=4 1676 B8R1.7 CC(=O)C1CCCS1 1458a_100012002731_200000210301 [1,0,0,1,0,0|0,1,1]=4 1677 B8R1.7 CC(=O)C1CCOC1 1458a_100000070787_100000690089 [1,0,0,1,0,0|2,0,0]=4 1678 B8R1.7 CC(=O)C1CCOC1 1458a_100011219752_200000210301 [1,0,0,1,0,0|2,0,0]=4 1679 B8R1.7 CC(=O)[C@@H]1CCCO1 1458a_100000686382_200000210301 [1,0,0,1,0,0|0,0,1]=3 1680 B8R1.7 [13CH3]C(=O)C1CC=CC1 1458a_100000759439_200025704644 [1,0,0,1,0,0|1,0,1]=4 1681 B8R1.7 [13CH3]C(=O)C1CCCC1 1458a_100000210718_200025704644 [1,0,0,1,0,0|1,0,1]=4 1682 B8R1.7 [13CH3]C(=O)C1CCCS1 1458a_100012002731_200025704644 [1,0,0,1,0,0|0,1,1]=4 1683 B8R1.7 [13CH3]C(=O)C1CCOC1 1458a_100011219752_200025704644 [1,0,0,1,0,0|2,0,0]=4 1684 B8R1.7 [13CH3]C(=O)[C@@H]1CCCO1 1458a_100000686382_200025704644 [1,0,0,1,0,0|0,0,1]=3 1685 B8R1.13 CCOC1CCC1=O 34a_100121572206_100009892977 [1,0,0,1,0,0|0,0,1]=3 1686 B8R1.13 CCSC1CCC1=O 62a_100000210202_100009892977 [1,0,0,1,0,0|0,1,1]=4 1687 B8R1.13 CCSC1CCC1=O 62a_100009892977_100000210202 [1,0,0,1,0,0|0,1,1]=4 1688 B8R1.23 C=C1CC(C1)C(=O)C 1458a_100000065620_200000210301 [1,0,0,1,0,0|1,0,1]=4 1689 B8R1.23 C=C1CC(C1)C(=O)[13CH3] 1458a_100000065620_200025704644 [1,0,0,1,0,0|1,0,1]=4 1690 B8R1.23 CC(=O)C1CC(C1)C 1458a_100000686124_200000210301 [1,0,0,1,0,0|1,0,1]=4 1691 B8R1.23 CC(=O)C1CN(C1)C 1458a_100012002723_200000210301 [1,0,0,1,0,0|2,0,0]=4 1692 B8R1.23 CC(=O)[C@@H]1CC(=O)N1 1458a_100016090685_200000210301 [1,0,0,1,0,0|1,0,0]=3 1693 B8R1.23 CC1CC(C1)C(=O)[13CH3] 1458a_100000686124_200025704644 [1,0,0,1,0,0|1,0,1]=4 1694 B8R1.23 CN1CC(C1)C(=O)[13CH3] 1458a_100012002723_200025704644 [1,0,0,1,0,0|2,0,0]=4 1695 B8R1.23 [13CH3]C(=O)[C@@H]1CC(=O)N1 1458a_100016090685_200025704644 [1,0,0,1,0,0|1,0,0]=3 1696 B8R1.78 CC(=O)C1(CCC1)C 1458a_100000684636_200000210301 [1,0,0,1,0,0|1,0,1]=4 1697 B8R1.78 CC(=O)C1(COC1)C 1458a_100000094709_200000210301 [1,0,0,1,0,0|2,0,0]=4 1698 B8R1.78 CC1(CCC1)C(=O)[13CH3] 1458a_100000684636_200025704644 [1,0,0,1,0,0|1,0,1]=4 1699 B8R1.78 CC1(COC1)C(=O)[13CH3] 1458a_100000094709_200025704644 [1,0,0,1,0,0|2,0,0]=4 1700 B8R1.35 CC(=O)COC1CC1 34a_100000211253_100000211595 [1,0,0,1,0,0|1,0,1]=4 1701 B10R1.13 C=C1CCC(CC1)C(=O)C 1458a_200000138047_200000210301 [0,0,0,1,0,1|2,0,0]=4 1702 B10R1.13 C=C1CCC(CC1)C(=O)[13CH3] 1458a_200000138047_200025704644 [0,0,0,1,0,1|2,0,0]=4 1703 B10R1.13 CC(=O)C1=NNC(=O)CC1 1458a_100000183032_200000210301 [0,0,0,1,0,1|1,0,1]=4 1704 B10R1.13 CC(=O)C1CC=C(CC1)C 1458a_100000137427_200000210301 [0,0,0,1,0,1|2,0,0]=4 1705 B10R1.13 CC(=O)C1CCC(=O)NC1 1458a_100000740907_200000210301 [0,0,0,1,0,1|1,0,0]=3 1706 B10R1.13 CC1=CCC(CC1)C(=O)[13CH3] 1458a_100000137427_200025704644 [0,0,0,1,0,1|2,0,0]=4 1707 B10R1.13 [13CH3]C(=O)C1=NNC(=O)CC1 1458a_100000183032_200025704644 [0,0,0,1,0,1|1,0,1]=4 1708 B10R1.13 [13CH3]C(=O)C1CCC(=O)NC1 1458a_100000740907_200025704644 [0,0,0,1,0,1|1,0,0]=3 1709 B10R1.58 CC(=O)C1CC(=O)N(C1)C 1458a_100000187535_200000210301 [0,0,0,1,0,1|2,0,0]=4 1710 B10R1.58 CN1CC(CC1=O)C(=O)[13CH3] 1458a_100000187535_200025704644 [0,0,0,1,0,1|2,0,0]=4 1711 B10R1.117 C=C(C)COC1CCC1=O 34a_100000210245_100009892977 [0,0,0,1,0,1|1,0,0]=3 1712 B10R1.117 C=C(C)CSC1CCC1=O 62a_100000748629_100009892977 [0,0,0,1,0,1|1,1,0]=4 1713 B10R1.117 C=C(C)CSC1CCC1=O 62a_100009892977_100000211660 [0,0,0,1,0,1|1,1,0]=4 1714 B10R1.117 C=C(F)COC1CCC1=O 34a_200010262243_100009892977 [0,0,0,1,0,1|1,0,1]=4 1715 B10R1.117 CC(=O)CCC1CCC1=O 1458a_100000070787_200016118888 [0,0,0,1,0,1|1,0,0]=3 1716 B10R1.117 CC(=O)COC1CCC1=O 34a_100000211253_100009892977 [0,0,0,1,0,1|0,0,0]=2 1717 B10R1.117 CC(Br)COC1CCC1=O 34a_100012180447_100009892977 [0,0,0,1,0,1|1,0,1]=4 1718 B10R1.117 CC(C)COC1CCC1=O 34a_100000210257_100009892977 [0,0,0,1,0,1|1,0,1]=4 1719 B10R1.117 CC(F)COC1CCC1=O 34a_100015925927_100009892977 [0,0,0,1,0,1|1,0,1]=4 1720 B10R1.117 C[C@@H](Cl)COC1CCC1=O 34a_100016084084_100009892977 [0,0,0,1,0,1|1,0,1]=4 1721 B10R1.117 C[C@@H](N)COC1CCC1=O 34a_100000737577_100009892977 [0,0,0,1,0,1|1,0,1]=4 1722 B10R1.117 NC(=O)CSC1CCC1=O 62a_100000747473_100009892977 [0,0,0,1,0,1|1,1,0]=4 1723 B10R1.117 NC(=O)CSC1CCC1=O 62a_100009892977_100000747473 [0,0,0,1,0,1|1,1,0]=4 1724 B10R1.117 O=C(O)CNC1CCC1=O 269956a_100016091260_100009892977 [0,0,0,1,0,1|2,0,0]=4 1725 B10R1.117 O=C([O-])CSC1CCC1=O 62a_100009892977_100020667443 [0,0,0,1,0,1|1,1,0]=4 1726 B10R1.117 O=C([O-])CSC1CCC1=O 62a_100020667443_100009892977 [0,0,0,1,0,1|1,1,0]=4 1727 B10R1.205 CC(=O)C(C)COC1CC1 34a_100000032740_100000211595 [0,0,0,1,0,1|1,0,1]=4 1728 B10R1.205 CC(=O)C(C)OCC1CC1 34a_100000212229_100000742324 [0,0,0,1,0,1|1,0,1]=4 1729 B10R1.205 CC(=O)C(C)OCC1CO1 34a_100000212229_102125554688 [0,0,0,1,0,1|0,0,2]=4 1730 B10R1.211 CC(=O)COC(C)C1CC1 1458a_200000137917_200000210301 [0,0,0,1,0,1|1,0,1]=4 1731 B10R1.211 CC(OCC(=O)[13CH3])C1CC1 1458a_200000137917_200025704644 [0,0,0,1,0,1|1,0,1]=4 1732 B10R1.349 CC(=O)C1CN(C1)C(=O)C 1458a_100000754717_200000210301 [0,0,0,1,0,1|1,0,0]=3 1733 B10R1.349 CC(=O)N1CC(C1)C(=O)N 240690a_100025753142_100015343762 [0,0,0,1,0,1|2,0,0]=4 1734 B10R1.349 CC(=O)N1CC(C1)C(=O)N 527a_100025753142_100103153847 [0,0,0,1,0,1|2,0,0]=4 1735 B10R1.349 CC(=O)N1CC(C1)C(=O)[13CH3] 1458a_100000754717_200025704644 [0,0,0,1,0,1|1,0,0]=3 1736 B10R1.470 CC(=O)C1(CC(=NO1)C)C 1458a_100000763712_200000210301 [0,0,0,1,0,1|1,0,0]=3 1737 B10R1.470 CC1=NOC(C1)(C)C(=O)[13CH3] 1458a_100000763712_200025704644 [0,0,0,1,0,1|1,0,0]=3 1738 B10R1.54 CC(=O)CC1CCC(=O)N1 1458a_100000026770_200000210301 [0,0,0,1,0,1|1,0,0]=3 1739 B10R1.54 CC(=O)CC1CNC(=O)O1 1458a_100000070787_100000181169 [0,0,0,1,0,1|1,0,0]=3 1740 B10R1.54 CC(=O)CC1COC(=O)O1 1458a_100000070787_100000073702 [0,0,0,1,0,1|1,0,0]=3 1741 B10R1.54 CC(=O)C[C@@H]1CCC(=O)N1 1458a_100000070787_100015189358 [0,0,0,1,0,1|1,0,0]=3 1742 B10R1.54 CC(=O)C[C@H]1COC(=O)N1 1458a_100000070787_100015307671 [0,0,0,1,0,1|2,0,0]=4 1743 B10R1.54 CC(=O)NC1CNC(=O)C1 11a_100000697751_100015343762 [0,0,0,1,0,1|2,0,0]=4 1744 B10R1.54 CC(=O)NC1CNC(=O)C1 1626a_100000697751_100015343762 [0,0,0,1,0,1|2,0,0]=4 1745 B10R1.54 CC(=O)NC1CNC(=O)C1 240690a_100000697751_100015343762 [0,0,0,1,0,1|2,0,0]=4 1746 B10R1.54 CC(=O)NC1CNC(=O)C1 527a_100000697751_100103153847 [0,0,0,1,0,1|2,0,0]=4 1747 B10R1.54 CC(C)OC1CCC(=O)C1 34a_100012614533_100000210206 [0,0,0,1,0,1|1,0,1]=4 1748 B10R1.54 [13CH3]C(=O)CC1CCC(=O)N1 1458a_100000026770_200025704644 [0,0,0,1,0,1|1,0,0]=3 1749 B10R1.268 CC(=O)OC(C)SC1CC1 62a_100009818208_100000211595 [0,0,0,1,0,1|1,0,1]=4 1750 B10R1.356 CC(=O)C(C)(C)OC1CC1 34a_100000747739_100000211595 [0,1,0,1,0,0|1,0,1]=4 1751 B10R1.442 CC(=O)NC1(CC1)C(=O)C 1458a_100012027092_200000210301 [0,1,0,1,0,0|1,0,0]=3 1752 B10R1.442 CC(=O)NC1(CC1)C(=O)N 11a_100000687655_100015343762 [0,1,0,1,0,0|2,0,0]=4 1753 B10R1.442 CC(=O)NC1(CC1)C(=O)N 240690a_100000687655_100015343762 [0,1,0,1,0,0|2,0,0]=4 1754 B10R1.442 CC(=O)NC1(CC1)C(=O)N 527a_100000687655_100103153847 [0,1,0,1,0,0|2,0,0]=4 1755 B10R1.442 CC(=O)NC1(CC1)C(=O)[13CH3] 1458a_100012027092_200025704644 [0,1,0,1,0,0|1,0,0]=3 1756 B10R1.14 CCC(=O)C1CCC(=O)N1 1458a_100000210400_100000210202 [0,1,0,1,0,0|1,0,0]=3 1757 B10R1.14 CCC(=O)C1CNC(=O)C1 1458a_100000747279_100000210202 [0,1,0,1,0,0|2,0,0]=4 1758 B10R1.14 CCC(=O)C1CNC(=O)N1 1458a_100000033324_100000210202 [0,1,0,1,0,0|2,0,0]=4 1759 B10R1.14 CCC(=O)[C@@H]1CCC(=O)O1 1458a_100009814974_100000210202 [0,1,0,1,0,0|0,0,0]=2 1760 B10R1.14 CCC(=O)[C@@H]1CSC(=O)N1 1458a_100000735014_100000210202 [0,1,0,1,0,0|2,0,0]=4 1761 B10R1.14 CNC(=O)C1CCC(=O)N1 240690a_100102657272_100000210400 [0,1,0,1,0,0|1,0,0]=3 1762 B10R1.14 CNC(=O)C1CNC(=O)C1 11a_106832991635_100000747279 [0,1,0,1,0,0|2,0,0]=4 1763 B10R1.14 CNC(=O)C1CNC(=O)C1 1626a_100102657272_100000747279 [0,1,0,1,0,0|2,0,0]=4 1764 B10R1.14 CNC(=O)C1CNC(=O)C1 240690a_100102657272_100000747279 [0,1,0,1,0,0|2,0,0]=4 1765 B10R1.14 CNC(=O)C1CNC(=O)C1 527a_100102657272_100000747279 [0,1,0,1,0,0|2,0,0]=4 1766 B10R1.14 CNC(=O)C1CNC(=O)N1 11a_106832991635_100000033324 [0,1,0,1,0,0|2,0,0]=4 1767 B10R1.14 CNC(=O)C1CNC(=O)N1 240690a_100102657272_100000033324 [0,1,0,1,0,0|2,0,0]=4 1768 B10R1.14 CNC(=O)[C@@H]1CCC(=O)O1 11a_106832991635_100009814974 [0,1,0,1,0,0|0,0,0]=2 1769 B10R1.14 CNC(=O)[C@@H]1CCC(=O)O1 1626a_100102657272_100009814974 [0,1,0,1,0,0|0,0,0]=2 1770 B10R1.14 CNC(=O)[C@@H]1CCC(=O)O1 240690a_100102657272_100009814974 [0,1,0,1,0,0|0,0,0]=2 1771 B10R1.14 CNC(=O)[C@@H]1CCC(=O)O1 527a_100102657272_100009814974 [0,1,0,1,0,0|0,0,0]=2 1772 B10R1.14 CNC(=O)[C@@H]1CSC(=O)N1 240690a_100102657272_100000735014 [0,1,0,1,0,0|2,0,0]=4 1773 B10R1.14 O=C1CC(CN1)C(=O)CF 1458a_100000747279_100015361967 [0,1,0,1,0,0|2,0,0]=4 1774 B10R1.14 O=C1CCC(N1)C(=O)CF 1458a_100000210400_100015361967 [0,1,0,1,0,0|1,0,0]=3 1775 B10R1.14 O=C1CC[C@H](O1)C(=O)CF 1458a_100009814974_100015361967 [0,1,0,1,0,0|0,0,0]=2 1776 B10R1.14 O=C1NCC(N1)C(=O)CF 1458a_100000033324_100015361967 [0,1,0,1,0,0|2,0,0]=4 1777 B10R1.14 O=C1N[C@@H](CS1)C(=O)CF 1458a_100000735014_100015361967 [0,1,0,1,0,0|2,0,0]=4 1778 B10R1.64 CC(=O)CN1CCCC1=O 1458a_100000189602_200000210301 [0,1,0,1,0,0|2,0,0]=4 1779 B10R1.64 CC(=O)CN1CCOC1=O 1458a_100011227918_200000210301 [0,1,0,1,0,0|2,0,0]=4 1780 B10R1.64 CC(=O)CN1CSCC1=O 1458a_100000008433_200000210301 [0,1,0,1,0,0|2,0,0]=4 1781 B10R1.64 CC(=O)NC1CCNC1=O 11a_100016995588_100015343762 [0,1,0,1,0,0|1,0,0]=3 1782 B10R1.64 CC(=O)NC1CCNC1=O 1626a_100016995588_100015343762 [0,1,0,1,0,0|1,0,0]=3 1783 B10R1.64 CC(=O)NC1CCNC1=O 240690a_100016995588_100015343762 [0,1,0,1,0,0|1,0,0]=3 1784 B10R1.64 CC(=O)NC1CCNC1=O 527a_100016995588_100103153847 [0,1,0,1,0,0|1,0,0]=3 1785 B10R1.64 CC(=O)NC1CCSC1=O 11a_100000184058_100015343762 [0,1,0,1,0,0|1,0,0]=3 1786 B10R1.64 CC(=O)NC1CCSC1=O 1626a_100000184058_100015343762 [0,1,0,1,0,0|1,0,0]=3 1787 B10R1.64 CC(=O)NC1CCSC1=O 240690a_100000184058_100015343762 [0,1,0,1,0,0|1,0,0]=3 1788 B10R1.64 CC(=O)NC1CCSC1=O 527a_100000184058_100103153847 [0,1,0,1,0,0|1,0,0]=3 1789 B10R1.64 CC(=O)N[C@@H]1CONC1=O 11a_100000765999_100015343762 [0,1,0,1,0,0|2,0,0]=4 1790 B10R1.64 CC(C)OC1CCCC1=O 34a_100000212225_100000709159 [0,1,0,1,0,0|1,0,1]=4 1791 B10R1.64 CC(C)OC1CCCC1=O 34a_200000719330_100000210206 [0,1,0,1,0,0|1,0,1]=4 1792 B10R1.64 CC(C)OC1CCOC1=O 34a_100000212225_100000211211 [0,1,0,1,0,0|1,0,1]=4 1793 B10R1.64 CC(C)O[C@H]1CCNC1=O 34a_100000688343_100000210206 [0,1,0,1,0,0|1,0,1]=4 1794 B10R1.64 [13CH3]C(=O)CN1CCCC1=O 1458a_100000189602_200025704644 [0,1,0,1,0,0|2,0,0]=4 1795 B10R1.64 [13CH3]C(=O)CN1CCOC1=O 1458a_100011227918_200025704644 [0,1,0,1,0,0|2,0,0]=4 1796 B10R1.64 [13CH3]C(=O)CN1CSCC1=O 1458a_100000008433_200025704644 [0,1,0,1,0,0|2,0,0]=4 1797 B10R1.184 COC(=O)C(C)OC1CC1 34a_100011215400_100000211595 [0,1,0,1,0,0|1,0,1]=4 1798 B10R1.194 CC(=O)[C@H]1CCC(=O)N1C 1458a_100010979499_200000210301 [0,1,0,1,0,0|1,0,0]=3 1799 B10R1.194 CN1C(=O)CC[C@@H]1C(=O)[13CH3] 1458a_100010979499_200025704644 [0,1,0,1,0,0|1,0,0]=3 1800 B10R1.266 CC(=O)OC(C)N1CCC1 269982a_100000754969_100009818208 [0,1,0,1,0,0|2,0,0]=4 1801 B10R1.408 COC(=O)C1CC1C(=O)C 1458a_100000750770_200000210301 [0,1,0,1,0,0|1,0,0]=3 1802 B10R1.408 COC(=O)C1CC1C(=O)[13CH3] 1458a_100000750770_200025704644 [0,1,0,1,0,0|1,0,0]=3 1803 B10R1.408 COC(=O)C1CN1C(=O)C 240690a_200009830135_100015343762 [0,1,0,1,0,0|1,0,0]=3 1804 B10R1.113 CC(=O)C1CCNC(=O)C1 1458a_100000132800_200000210301 [0,1,0,1,0,0|1,0,0]=3 1805 B10R1.113 CC(=O)C1CSCC(=O)N1 1458a_100000045068_200000210301 [0,1,0,1,0,0|1,0,0]=3 1806 B10R1.113 CC(=O)N1CCNC(=O)C1 11a_100000184651_100015343762 [0,1,0,1,0,0|2,0,0]=4 1807 B10R1.113 CC(=O)N1CCNC(=O)C1 1626a_100000184651_100015343762 [0,1,0,1,0,0|2,0,0]=4 1808 B10R1.113 CC(=O)N1CCNC(=O)C1 240690a_100000184651_100015343762 [0,1,0,1,0,0|2,0,0]=4 1809 B10R1.113 CC(=O)N1CCNC(=O)C1 527a_100000184651_100103153847 [0,1,0,1,0,0|2,0,0]=4 1810 B10R1.113 CC(=O)N1CCOC(=O)C1 11a_100000131268_100015343762 [0,1,0,1,0,0|2,0,0]=4 1811 B10R1.113 CC(=O)N1CCOC(=O)C1 240690a_100000131268_100015343762 [0,1,0,1,0,0|2,0,0]=4 1812 B10R1.113 CC(=O)N1CCOC(=O)C1 527a_100000131268_100103153847 [0,1,0,1,0,0|2,0,0]=4 1813 B10R1.113 CC(=O)[C@@H]1CCN=C(N1)C 1458a_100015271614_200000210301 [0,1,0,1,0,0|2,0,0]=4 1814 B10R1.113 CC(=O)[C@H]1CCCC(=O)N1 1458a_100000705292_200000210301 [0,1,0,1,0,0|1,0,0]=3 1815 B10R1.113 CC1=NCC[C@H](N1)C(=O)[13CH3] 1458a_100015271614_200025704644 [0,1,0,1,0,0|2,0,0]=4 1816 B10R1.113 [13CH3]C(=O)C1CCNC(=O)C1 1458a_100000132800_200025704644 [0,1,0,1,0,0|1,0,0]=3 1817 B10R1.113 [13CH3]C(=O)C1CSCC(=O)N1 1458a_100000045068_200025704644 [0,1,0,1,0,0|1,0,0]=3 1818 B10R1.113 [13CH3]C(=O)[C@H]1CCCC(=O)N1 1458a_100000705292_200025704644 [0,1,0,1,0,0|1,0,0]=3 1819 B10R1.361 CC(=O)N1CC[C@H]1C(=O)[13CH3] 1458a_200015362969_200025704644 [0,1,0,1,0,0|1,0,0]=3 1820 B10R1.361 CC(=O)[C@@H]1CCN1C(=O)C 1458a_200015362969_200000210301 [0,1,0,1,0,0|1,0,0]=3 1821 B10R1.116 C=C(C)C(=O)C1CCC1=O 1458a_100000185857_100009892977 [0,1,0,1,0,0|2,0,0]=4 1822 B10R1.203 CC(=O)C(C)OC1(CC1)C 7a_100011725673_100000179758 [0,1,0,1,0,0|1,0,1]=4 1823 B10R1.204 CC(=O)C(C)OC1CCC1 34a_100000212229_100000749161 [0,1,0,1,0,0|1,0,1]=4 1824 B10R1.204 CC(=O)C(C)OC1COC1 34a_100000212229_100009818527 [0,1,0,1,0,0|0,0,2]=4 1825 B10R1.204 CC(=O)C(C)OC1CSC1 7a_100000072292_100000179758 [0,1,0,1,0,0|0,1,1]=4 1826 B10R1.463 C#C[C@@H](C)OC1CCC1=O 34a_100009815206_100009892977 [0,1,0,1,0,0|1,0,1]=4 1827 B10R1.463 C#C[C@@H](C)OC1CCC1=O 7a_100009815206_100009892977 [0,1,0,1,0,0|1,0,1]=4 1828 B10R1.463 C=CC(C)OC1CCC1=O 34a_100000695699_100009892977 [0,1,0,1,0,0|1,0,1]=4 1829 B10R1.463 CC(C#N)OC1CCC1=O 34a_100011218135_100009892977 [0,1,0,1,0,0|1,0,1]=4 1830 B10R1.463 CC(CF)OC1CCC1=O 34a_100016041109_100009892977 [0,1,0,1,0,0|1,0,1]=4 1831 B10R1.463 CC(CF)OC1CCC1=O 7a_100016041109_100009892977 [0,1,0,1,0,0|1,0,1]=4 1832 B10R1.463 CC(CN)OC1CCC1=O 34a_100000210904_100009892977 [0,1,0,1,0,0|1,0,1]=4 1833 B10R1.463 CCC(C)OC1CCC1=O 7a_100000210228_100009892977 [0,1,0,1,0,0|1,0,1]=4 1834 B10R1.106 CC(C)(C)OC1CCC1=O 34a_100015890283_100009892977 [0,1,0,1,0,0|1,0,1]=4 1835 B10R1.106 CC(C)(C)OC1CCC1=O 7a_100015890283_100009892977 [0,1,0,1,0,0|1,0,1]=4 1836 B8R0.28 C=C(C)CNNC(=O)C 22a_100000729518_100000070787 [1,0,0,0,0,1|2,0,0]=4 1837 B8R0.28 C=C(C)COCC(=C)C 34a_100000210245_100000748629 [1,0,0,0,0,1|2,0,0]=4 1838 B8R0.28 C=C(C)COCC(=O)C 34a_100000211253_100000748629 [1,0,0,0,0,1|1,0,0]=3 1839 B8R0.28 C=C(C)COCC(=O)N 34a_100000210245_100000187820 [1,0,0,0,0,1|2,0,0]=4 1840 B8R0.28 C=C(C)COCC(=O)[O-] 34a_100000210245_100020667443 [1,0,0,0,0,1|2,0,0]=4 1841 B8R0.28 C=C(F)COCC(=O)C 34a_100000211253_100009893438 [1,0,0,0,0,1|1,0,1]=4 1842 B8R0.28 CC(=O)CCC=C(C)C 1458a_100000070787_100011217483 [1,0,0,0,0,1|2,0,0]=4 1843 B8R0.28 CC(=O)CCCC(=O)C 1458a_100000070787_100011215641 [1,0,0,0,0,1|1,0,0]=3 1844 B8R0.28 CC(=O)CCCC(=O)N 1458a_100000070787_100102525003 [1,0,0,0,0,1|2,0,0]=4 1845 B8R0.28 CC(=O)CCNC(=O)C 1458a_100000070787_100000189650 [1,0,0,0,0,1|1,0,0]=3 1846 B8R0.28 CC(=O)CCNC(=O)C 1458a_100000183196_200000210301 [1,0,0,0,0,1|1,0,0]=3 1847 B8R0.28 CC(=O)CCNC(=O)N 1458a_100000070787_200000034859 [1,0,0,0,0,1|2,0,0]=4 1848 B8R0.28 CC(=O)CCNC(=O)N 1458a_100000181464_200000210301 [1,0,0,0,0,1|2,0,0]=4 1849 B8R0.28 CC(=O)CCOC(=O)C 1458a_100000070787_100009814007 [1,0,0,0,0,1|0,0,0]=2 1850 B8R0.28 CC(=O)CCOC(=O)N 1458a_100000070787_200011214921 [1,0,0,0,0,1|1,0,0]=3 1851 B8R0.28 CC(=O)CCOC(C)C 1458a_100000070787_100000211751 [1,0,0,0,0,1|1,0,1]=4 1852 B8R0.28 CC(=O)CCOC(C)C 34a_100000759926_100000210206 [1,0,0,0,0,1|1,0,1]=4 1853 B8R0.28 CC(=O)CCOC(C)C 7a_100000759926_100000210206 [1,0,0,0,0,1|1,0,1]=4 1854 B8R0.28 CC(=O)CCSC(=O)C 1458a_100000048949_200000210301 [1,0,0,0,0,1|0,1,0]=3 1855 B8R0.28 CC(=O)COCC(=O)N 1458a_100011219004_200000210301 [1,0,0,0,0,1|1,0,0]=3 1856 B8R0.28 CC(=O)COCC(=O)N 34a_100000211253_100000187820 [1,0,0,0,0,1|1,0,0]=3 1857 B8R0.28 CC(=O)COCC(=O)[O-] 34a_100000211253_100020667443 [1,0,0,0,0,1|1,0,0]=3 1858 B8R0.28 CC(=O)COCC(C)C 1458a_100011223364_200000210301 [1,0,0,0,0,1|1,0,1]=4 1859 B8R0.28 CC(=O)COCC(C)C 34a_100000211253_100000210624 [1,0,0,0,0,1|1,0,1]=4 1860 B8R0.28 CC(=O)COCC(C)O 34a_100000211253_100011218427 [1,0,0,0,0,1|0,0,2]=4 1861 B8R0.28 CC(=O)COC[C@@H](C)O 34a_100000211253_100009817552 [1,0,0,0,0,1|0,0,2]=4 1862 B8R0.28 CC(=O)COC[N+](=O)[O-] 34a_100000211253_100000761209 [1,0,0,0,0,1|2,0,0]=4 1863 B8R0.28 CC(=O)NCC=C(C)C 11a_100000718196_100015343762 [1,0,0,0,0,1|2,0,0]=4 1864 B8R0.28 CC(=O)NCC=C(C)C 1626a_100000718196_100015343762 [1,0,0,0,0,1|2,0,0]=4 1865 B8R0.28 CC(=O)NCC=C(C)C 527a_100000718196_100103153847 [1,0,0,0,0,1|2,0,0]=4 1866 B8R0.28 CC(=O)NCCC(=O)N 11a_100000740010_100015343762 [1,0,0,0,0,1|2,0,0]=4 1867 B8R0.28 CC(=O)NCCC(=O)N 240690a_100000740010_100015343762 [1,0,0,0,0,1|2,0,0]=4 1868 B8R0.28 CC(=O)NCCC(=O)N 527a_100000740010_100103153847 [1,0,0,0,0,1|2,0,0]=4 1869 B8R0.28 CC(=O)NCCC(=O)[13CH3] 1458a_100000183196_200025704644 [1,0,0,0,0,1|1,0,0]=3 1870 B8R0.28 CC(=O)OCCN(C)C 269982a_100102631434_100009814007 [1,0,0,0,0,1|2,0,0]=4 1871 B8R0.28 CC(=O)OCNC(C)C 34a_100138425928_100009813279 [1,0,0,0,0,1|1,0,1]=4 1872 B8R0.28 CC(=O)OCOC(C)C 34a_100000212225_100009813279 [1,0,0,0,0,1|1,0,1]=4 1873 B8R0.28 CC(=O)OCSC(C)C 62a_100000076356_100000210206 [1,0,0,0,0,1|1,0,1]=4 1874 B8R0.28 CC(=O)OCSC(C)C 62a_100000210206_100000076356 [1,0,0,0,0,1|1,0,1]=4 1875 B8R0.28 CC(=O)SCCC(=O)[13CH3] 1458a_100000048949_200025704644 [1,0,0,0,0,1|0,1,0]=3 1876 B8R0.28 CC(C)COCC(=O)[13CH3] 1458a_100011223364_200025704644 [1,0,0,0,0,1|1,0,1]=4 1877 B8R0.28 [13CH3]C(=O)CCNC(=O)N 1458a_100000181464_200025704644 [1,0,0,0,0,1|2,0,0]=4 1878 B8R0.28 [13CH3]C(=O)COCC(=O)N 1458a_100011219004_200025704644 [1,0,0,0,0,1|1,0,0]=3 1879 B10R0.96 C=C(C)CN(C)COC(=O)C 269982a_100000225649_100000076356 [0,0,0,0,0,2|2,0,0]=4 1880 B10R0.96 C=C(C)COC(C)C=C(C)C 34a_100000717055_100000748629 [0,0,0,0,0,2|2,0,0]=4 1881 B10R0.96 C=C(C)CSC(C)OC(=O)C 62a_100000748629_100009818208 [0,0,0,0,0,2|1,1,0]=4 1882 B10R0.96 C=C(C)CSC(C)OC(=O)C 62a_100009818208_100000211660 [0,0,0,0,0,2|1,1,0]=4 1883 B10R0.96 CC(=CC(C)OCC(=O)N)C 34a_100000717055_100000187820 [0,0,0,0,0,2|2,0,0]=4 1884 B10R0.96 CC(=CC(C)OCC(=O)[O-])C 34a_100000717055_100020667443 [0,0,0,0,0,2|2,0,0]=4 1885 B10R0.96 CC(=O)CC(C)CSC(=O)C 1458a_100000070787_200000116872 [0,0,0,0,0,2|0,1,0]=3 1886 B10R0.96 CC(=O)COC(C)CC(C)C 34a_100000211253_100000731052 [0,0,0,0,0,2|1,0,1]=4 1887 B10R0.96 CC(=O)OC(C)NCC(=O)O 269956a_100016091260_100009818208 [0,0,0,0,0,2|2,0,0]=4 1888 B10R0.96 CC(=O)OC(C)SCC(=O)N 62a_100000747473_100009818208 [0,0,0,0,0,2|1,1,0]=4 1889 B10R0.96 CC(=O)OC(C)SCC(=O)N 62a_100009818208_100000747473 [0,0,0,0,0,2|1,1,0]=4 1890 B10R0.96 CC(=O)OC(C)SCC(=O)[O-] 62a_100009818208_100020667443 [0,0,0,0,0,2|1,1,0]=4 1891 B10R0.96 CC(=O)OC(C)SCC(=O)[O-] 62a_100020667443_100009818208 [0,0,0,0,0,2|1,1,0]=4 1892 B10R0.96 CC(=O)OCN(C)CC(=O)O 269956a_100000746989_100000076356 [0,0,0,0,0,2|2,0,0]=4 1893 B10R0.98 C=C(C)CCOC(C)C(=O)C 34a_100000212229_100000730704 [0,0,0,0,0,2|1,0,0]=3 1894 B10R0.98 C=C(C)CCOC(C)C(=O)N 34a_100000764851_100000702099 [0,0,0,0,0,2|2,0,0]=4 1895 B10R0.98 C=C(C)CCO[C@@H](C)C(=O)[O-] 7a_217856618621_100000730704 [0,0,0,0,0,2|2,0,0]=4 1896 B10R0.98 C=C(C)CCO[C@H](C)C(=O)N 34a_100000731257_100000730704 [0,0,0,0,0,2|2,0,0]=4 1897 B10R0.98 C=C(C)CCO[C@H](C)C(=O)N 7a_100000731257_100000730704 [0,0,0,0,0,2|2,0,0]=4 1898 B10R0.98 C=C(C)CCSC(C)C(=O)C 62a_100000730704_100009814033 [0,0,0,0,0,2|1,1,0]=4 1899 B10R0.98 C=C(C)CCSC(C)C(=O)C 62a_100009814033_100000730704 [0,0,0,0,0,2|1,1,0]=4 1900 B10R0.98 C=C(C)COCC(C)C(=O)C 34a_100000032740_100000748629 [0,0,0,0,0,2|1,0,0]=3 1901 B10R0.98 C=C(C)COCC(C)C(=O)C 7a_100000032740_100000748629 [0,0,0,0,0,2|1,0,0]=3 1902 B10R0.98 C=C(F)COCC(C)C(=O)C 34a_100000032740_100009893438 [0,0,0,0,0,2|1,0,1]=4 1903 B10R0.98 C=C(F)COCC(C)C(=O)C 7a_100000032740_100000042424 [0,0,0,0,0,2|1,0,1]=4 1904 B10R0.98 CC(=CCOC(C)C(=O)N)C 34a_100000753907_100000702099 [0,0,0,0,0,2|2,0,0]=4 1905 B10R0.98 CC(=CCO[C@@H](C)C(=O)[O-])C 7a_217856618621_100000761012 [0,0,0,0,0,2|2,0,0]=4 1906 B10R0.98 CC(=CCO[C@H](C)C(=O)N)C 34a_100000731257_100000761012 [0,0,0,0,0,2|2,0,0]=4 1907 B10R0.98 CC(=CCO[C@H](C)C(=O)N)C 7a_100000731257_100000761012 [0,0,0,0,0,2|2,0,0]=4 1908 B10R0.98 CC(=O)C(C)COCC(=O)N 34a_100000032740_100000187820 [0,0,0,0,0,2|1,0,0]=3 1909 B10R0.98 CC(=O)C(C)COCC(=O)N 7a_100000032740_100000187820 [0,0,0,0,0,2|1,0,0]=3 1910 B10R0.98 CC(=O)C(C)COCC(=O)[O-] 34a_100000032740_100020667443 [0,0,0,0,0,2|1,0,0]=3 1911 B10R0.98 CC(=O)C(C)COCC(C)C 34a_100000032740_100000210624 [0,0,0,0,0,2|1,0,1]=4 1912 B10R0.98 CC(=O)C(C)COCC(C)C 7a_100000032740_100000210760 [0,0,0,0,0,2|1,0,1]=4 1913 B10R0.98 CC(=O)C(C)COCC(C)O 34a_100000032740_100011218427 [0,0,0,0,0,2|0,0,2]=4 1914 B10R0.98 CC(=O)C(C)COCC(C)O 7a_100000032740_100011218427 [0,0,0,0,0,2|0,0,2]=4 1915 B10R0.98 CC(=O)C(C)COC[C@@H](C)O 34a_100000032740_100009817552 [0,0,0,0,0,2|0,0,2]=4 1916 B10R0.98 CC(=O)C(C)COC[C@@H](C)O 7a_100000032740_100009817552 [0,0,0,0,0,2|0,0,2]=4 1917 B10R0.98 CC(=O)C(C)COC[N+](=O)[O-] 34a_100000032740_100000761209 [0,0,0,0,0,2|2,0,0]=4 1918 B10R0.98 CC(=O)C(C)NOCC(=O)O 269956a_100000106656_100009814033 [0,0,0,0,0,2|1,0,0]=3 1919 B10R0.98 CC(=O)C(C)OCC=C(C)C 34a_100000212229_100000761012 [0,0,0,0,0,2|1,0,0]=3 1920 B10R0.98 CC(=O)C(C)OCCC(=O)N 34a_100000212229_100000731001 [0,0,0,0,0,2|1,0,0]=3 1921 B10R0.98 CC(=O)C(C)OCCC(=O)N 7a_100000757172_100000179758 [0,0,0,0,0,2|1,0,0]=3 1922 B10R0.98 CC(=O)C(C)OCCC(C)C 34a_100000212229_100000210312 [0,0,0,0,0,2|1,0,1]=4 1923 B10R0.98 CC(=O)C(C)OCCC(C)C 7a_100000210254_100000179758 [0,0,0,0,0,2|1,0,1]=4 1924 B10R0.98 CC(=O)C(C)OCCC(C)O 34a_100000212229_100012276601 [0,0,0,0,0,2|0,0,2]=4 1925 B10R0.98 CC(=O)C(C)OCOC(C)C 34a_100000212229_100000709892 [0,0,0,0,0,2|1,0,1]=4 1926 B10R0.98 CC(=O)C(C)SCC=C(C)C 62a_100000761012_100009814033 [0,0,0,0,0,2|1,1,0]=4 1927 B10R0.98 CC(=O)C(C)SCC=C(C)C 62a_100009814033_100000761012 [0,0,0,0,0,2|1,1,0]=4 1928 B10R0.98 CC(=O)C(C)SCCC(=O)N 62a_100000744528_100009814033 [0,0,0,0,0,2|1,1,0]=4 1929 B10R0.98 CC(=O)C(C)SCCC(=O)N 62a_100009814033_100000744528 [0,0,0,0,0,2|1,1,0]=4 1930 B10R0.98 CC(=O)C(C)SCOC(C)C 62a_100000709892_100009814033 [0,0,0,0,0,2|1,0,1]=4 1931 B10R0.98 CC(=O)C(C)SCOC(C)C 62a_100009814033_100000709892 [0,0,0,0,0,2|1,0,1]=4 1932 B10R0.98 CC(=O)CCN[C@@H](C)C(=O)O 269956a_100000743915_100000053229 [0,0,0,0,0,2|2,0,0]=4 1933 B10R0.98 CC(=O)CCOC(C)C(=O)C 7a_100000759926_100000179758 [0,0,0,0,0,2|0,0,0]=2 1934 B10R0.98 CC(=O)CCOC(C)C(=O)N 34a_100000759926_100000702099 [0,0,0,0,0,2|1,0,0]=3 1935 B10R0.98 CC(=O)CCOC(C)C(=O)N 7a_100000759926_100000702099 [0,0,0,0,0,2|1,0,0]=3 1936 B10R0.98 CC(=O)CCOC(C)C(C)C 7a_100000748068_100000053229 [0,0,0,0,0,2|1,0,1]=4 1937 B10R0.98 CC(=O)CCOC(F)C(=O)N 34a_100000759926_100009813875 [0,0,0,0,0,2|2,0,0]=4 1938 B10R0.98 CC(=O)CCOC(F)C(=O)N 7a_100000759926_100009813875 [0,0,0,0,0,2|2,0,0]=4 1939 B10R0.98 CC(=O)CCOC(F)C(=O)[O-] 34a_100000759926_100020610796 [0,0,0,0,0,2|2,0,0]=4 1940 B10R0.98 CC(=O)CCO[C@@H](C)C(=O)[O-] 7a_217856618621_100000053229 [0,0,0,0,0,2|1,0,0]=3 1941 B10R0.98 CC(=O)CCO[C@H](C)C(=O)N 7a_100000731257_100000053229 [0,0,0,0,0,2|1,0,0]=3 1942 B10R0.98 CC(=O)CCSC(C)C(=O)C 62a_100000053229_100009814033 [0,0,0,0,0,2|0,1,0]=3 1943 B10R0.98 CC(=O)CCSC(C)C(=O)C 62a_100009814033_100000053229 [0,0,0,0,0,2|0,1,0]=3 1944 B10R0.98 CC(=O)CCSC(C)C(=O)N 62a_100000053229_100000702099 [0,0,0,0,0,2|1,1,0]=4 1945 B10R0.98 CC(=O)CCSC(C)C(=O)N 62a_100000702099_100000053229 [0,0,0,0,0,2|1,1,0]=4 1946 B10R0.98 CC(=O)COCC(=O)C(=O)C 34a_100000211253_100011261029 [0,0,0,0,0,2|1,0,1]=4 1947 B10R0.98 CC(=O)OCN[C@@H](C)C(=O)O 269956a_100000743915_100000076356 [0,0,0,0,0,2|1,0,0]=3 1948 B10R0.98 CC(=O)OCN[C@H](C)C(=O)N 34a_100000119354_100009813279 [0,0,0,0,0,2|1,0,0]=3 1949 B10R0.98 CC(=O)OCOC(C)C(=O)C 34a_100000212229_100009813279 [0,0,0,0,0,2|0,0,0]=2 1950 B10R0.98 CC(=O)OCO[C@H](C)C(=O)N 34a_100000731257_100009813279 [0,0,0,0,0,2|1,0,0]=3 1951 B10R0.98 CC(=O)OCSC(C)C(=O)C 62a_100000076356_100009814033 [0,0,0,0,0,2|0,0,0]=2 1952 B10R0.98 CC(=O)OCSC(C)C(=O)C 62a_100009814033_100000076356 [0,0,0,0,0,2|0,0,0]=2 1953 B10R0.98 CC(=O)OCSC(C)C(=O)N 62a_100000076356_100000702099 [0,0,0,0,0,2|1,0,0]=3 1954 B10R0.98 CC(=O)OCSC(C)C(=O)N 62a_100000702099_100000076356 [0,0,0,0,0,2|1,0,0]=3 1955 B10R0.98 CC(=O)OCSC(F)C(=O)N 62a_100000076356_100009813875 [0,0,0,0,0,2|2,0,0]=4 1956 B10R0.98 CC(=O)OCSC(F)C(=O)N 62a_100009813875_100000076356 [0,0,0,0,0,2|2,0,0]=4 1957 B10R0.98 CC(=O)OCSC(F)C(=O)[O-] 62a_100000076356_100020610796 [0,0,0,0,0,2|2,0,0]=4 1958 B10R0.98 CC(=O)OCSC(F)C(=O)[O-] 62a_100020610796_100000076356 [0,0,0,0,0,2|2,0,0]=4 1959 B10R0.98 CC(OCCC(=O)N)C(=O)N 34a_100000757172_100000702099 [0,0,0,0,0,2|2,0,0]=4 1960 B10R0.98 CC(OCCC(=O)N)C(=O)N 7a_100000757172_100000702099 [0,0,0,0,0,2|2,0,0]=4 1961 B10R0.98 C[C@@H](OCCC(=O)N)C(=O)N 34a_100000731257_100000731001 [0,0,0,0,0,2|2,0,0]=4 1962 B10R0.98 C[C@@H](OCCC(=O)N)C(=O)N 7a_100000731257_100000744528 [0,0,0,0,0,2|2,0,0]=4 1963 B10R0.98 C[C@H](OCCC(=O)N)C(=O)[O-] 7a_217856618621_100000744528 [0,0,0,0,0,2|2,0,0]=4