0 B8R0.24 CC(C)(C)CC(=O)NO MCULE-7851302505 [0,0,0,0,0,0|4,0,0]=4 1 B8R0.24 CN(C=O)CP(=O)(O)O MCULE-5250485746 [0,0,0,0,0,0|3,0,1]=4 2 B8R0.24 CNC(=O)CS(=O)(=O)C MCULE-7688916364 [0,0,0,0,0,0|3,0,1]=4 3 B8R0.24 COC(=O)CP(=O)(O)O MCULE-7218551741 [0,0,0,0,0,0|2,0,0]=2 4 B8R0.24 COC(=O)CS(=O)(=O)O MCULE-8404555176 [0,0,0,0,0,0|3,0,1]=4 5 B8R0.24 CS(=O)(=O)CC(=O)NN MCULE-5238237367 [0,0,0,0,0,0|3,0,1]=4 6 B8R0.24 O=C(CP(=O)(O)O)NO MCULE-2272923571 [0,0,0,0,0,0|0,0,0]=0 7 B8R0.24 [NH3+]CC(O)CP(=O)(O)O MCULE-1909194599 [0,0,0,0,0,0|2,0,2]=4 8 B8R0.24 [NH3+]CC(O)CP(=O)(O)O MCULE-2988447435 [0,0,0,0,0,0|2,0,2]=4 9 B7R0.2 CC(O)CC(=O)NN MCULE-2521784411 [1,0,0,0,0,0|3,0,0]=4 10 B7R0.2 CCC(=O)CC(=O)O MCULE-1083768149 [1,0,0,0,0,0|3,0,0]=4 11 B7R0.2 CNC(=O)CC(=O)C MCULE-4316009681 [1,0,0,0,0,0|3,0,0]=4 12 B7R0.2 CNC(=O)CC(=O)O MCULE-3506871336 [1,0,0,0,0,0|2,0,0]=3 13 B7R0.2 CNC(=O)CN(=O)=O MCULE-2253664059 [1,0,0,0,0,0|1,1,1]=4 14 B7R0.2 COC(=O)CC(=O)O MCULE-7983457925 [1,0,0,0,0,0|3,0,0]=4 15 B7R0.2 N/C(=N/O)/CC(=O)O MCULE-5236282846 [1,0,0,0,0,0|2,0,1]=4 16 B7R0.2 NNC(=O)CN(=O)=O MCULE-9562845907 [1,0,0,0,0,0|1,1,1]=4 17 B7R0.2 O=C(O)CC(=O)CCl MCULE-9671015150 [1,0,0,0,0,0|3,0,0]=4 18 B7R0.2 O=C(O)CC(=O)CO MCULE-2224143705 [1,0,0,0,0,0|2,0,0]=3 19 B7R0.8 CC/C=C/P(=O)(O)O MCULE-7978096920 [1,0,0,0,0,0|2,0,1]=4 20 B7R0.8 CCCCP(=O)(O)O MCULE-8779445551 [1,0,0,0,0,0|2,0,1]=4 21 B7R0.8 NCCCP(=O)(O)O MCULE-7175026527 [1,0,0,0,0,0|2,0,1]=4 22 B7R0.8 O=P(O)(O)CCCBr MCULE-8428985634 [1,0,0,0,0,0|2,0,1]=4 23 B7R0.8 O=P(O)(O)CCCCl MCULE-9259107636 [1,0,0,0,0,0|2,0,1]=4 24 B7R0.9 CC(=O)OP(=O)(O)O MCULE-3093243474 [1,0,0,0,0,0|2,0,0]=3 25 B7R0.9 CC(C)(O)CC(=O)O MCULE-3649642958 [1,0,0,0,0,0|3,0,0]=4 26 B7R0.9 CC(C)CP(=O)(O)O MCULE-5164389604 [1,0,0,0,0,0|2,0,1]=4 27 B7R0.9 CS(=O)(=O)CC(=O)N MCULE-1619614870 [1,0,0,0,0,0|2,0,1]=4 28 B7R0.9 CS(=O)(=O)CC(=O)O MCULE-1982886035 [1,0,0,0,0,0|2,0,1]=4 29 B7R0.9 NC(=O)CS(=O)(=O)N MCULE-5735073011 [1,0,0,0,0,0|2,0,1]=4 30 B7R0.9 NC(=O)OP(=O)(O)O MCULE-8071699770 [1,0,0,0,0,0|1,0,0]=2 31 B7R0.9 NC(=O)OP(=O)([O-])[O-] MCULE-1371666805 [1,0,0,0,0,0|1,0,2]=4 32 B7R0.9 NC(=O)OP(=O)([O-])[O-] MCULE-5646051548 [1,0,0,0,0,0|1,0,2]=4 33 B7R0.9 NS(=O)(=O)CC(=O)O MCULE-1039009855 [1,0,0,0,0,0|2,0,1]=4 34 B7R0.9 O=C(O)CP(=O)(O)O MCULE-7055994360 [1,0,0,0,0,0|0,0,0]=1 35 B7R0.9 O=C(O)CS(=O)(=O)O MCULE-4846153382 [1,0,0,0,0,0|1,0,1]=3 36 B9R0.57 C=C(OP(=O)(O)O)C(=O)O MCULE-3602390360 [0,1,0,0,0,0|3,0,0]=4 37 B9R0.57 C=C(OP(=O)(O)O)C(=O)O MCULE-8044116150 [0,1,0,0,0,0|3,0,0]=4 38 B9R0.57 C[C@@H](N)C(=O)OP(=O)(O)O MCULE-5665170194 [0,1,0,0,0,0|3,0,0]=4 39 B9R0.57 NC(CP(=O)(O)O)C(=O)O MCULE-3742656954 [0,1,0,0,0,0|2,0,1]=4 40 B9R0.57 N[C@@H](CP(=O)(O)O)C(=O)O MCULE-6935567843 [0,1,0,0,0,0|2,0,1]=4 41 B9R0.21 O=C(CO)COP(=O)(O)O MCULE-3352535301 [0,0,0,0,0,1|1,0,0]=2 42 B9R0.21 O=C(CO)COP(=O)([O-])[O-] MCULE-1009530625 [0,0,0,0,0,1|1,0,2]=4 43 B9R0.21 O=P(O)(O)OCC(O)CO MCULE-1053997818 [0,0,0,0,0,1|1,0,2]=4 44 B9R0.21 O=P(O)(O)OC[C@H](O)CO MCULE-1337563082 [0,0,0,0,0,1|1,0,2]=4 45 B9R0.21 O=P(O)(O)OC[C@H](O)CO MCULE-2982304745 [0,0,0,0,0,1|1,0,2]=4 46 B9R0.21 O=P(O)(O)OC[C@H](O)CO MCULE-9577432755 [0,0,0,0,0,1|1,0,2]=4 47 B6R0.1 CCCC(=O)NO MCULE-8710375368 [2,0,0,0,0,0|2,0,0]=4 48 B6R0.1 CNC(=O)CCO MCULE-3222339741 [2,0,0,0,0,0|2,0,0]=4 49 B6R0.1 NNC(=O)CCO MCULE-6184351353 [2,0,0,0,0,0|2,0,0]=4 50 B6R0.1 O=C(CCCl)NO MCULE-5569658108 [2,0,0,0,0,0|2,0,0]=4 51 B6R0.2 CC(=O)CC(=O)N MCULE-1618058771 [2,0,0,0,0,0|2,0,0]=4 52 B6R0.2 CC(=O)CC(=O)O MCULE-2601276539 [2,0,0,0,0,0|2,0,0]=4 53 B6R0.2 CC(O)CC(=O)N MCULE-7442557911 [2,0,0,0,0,0|2,0,0]=4 54 B6R0.2 CC(O)CC(=O)O MCULE-3566732882 [2,0,0,0,0,0|2,0,0]=4 55 B6R0.2 CC(O)CC(=O)O MCULE-6537877725 [2,0,0,0,0,0|2,0,0]=4 56 B6R0.2 C[C@@H](O)CC(=O)O MCULE-2545577683 [2,0,0,0,0,0|2,0,0]=4 57 B6R0.2 C[C@@H](O)CC(=O)O MCULE-4159227891 [2,0,0,0,0,0|2,0,0]=4 58 B6R0.2 C[C@H](O)CC(=O)O MCULE-2857686566 [2,0,0,0,0,0|2,0,0]=4 59 B6R0.2 C[C@H](O)CC(=O)O MCULE-3362266278 [2,0,0,0,0,0|2,0,0]=4 60 B6R0.2 NC(=O)CC(=O)N MCULE-7675159766 [2,0,0,0,0,0|2,0,0]=4 61 B6R0.2 NC(=O)CC(=O)O MCULE-1168254626 [2,0,0,0,0,0|1,0,0]=3 62 B6R0.2 NC(=O)CN(=O)=O MCULE-2051107739 [2,0,0,0,0,0|0,1,1]=4 63 B6R0.2 NC(=O)CN(=O)=O MCULE-6284821429 [2,0,0,0,0,0|0,1,1]=4 64 B6R0.2 O=C(O)CB(O)O MCULE-6408403753 [2,0,0,0,0,0|1,0,0]=3 65 B6R0.2 O=C(O)CC(=O)O MCULE-5893043131 [2,0,0,0,0,0|1,0,0]=3 66 B6R0.2 O=C(O)CN(=O)=O MCULE-4962751453 [2,0,0,0,0,0|0,1,1]=4 67 B6R0.5 C/C=C\P(=O)(O)O MCULE-8382984782 [2,0,0,0,0,0|1,0,1]=4 68 B6R0.5 CC=CP(=O)(O)O MCULE-3593796042 [2,0,0,0,0,0|1,0,1]=4 69 B6R0.5 CCCP(=O)(O)O MCULE-3928382731 [2,0,0,0,0,0|1,0,1]=4 70 B6R0.5 CNCP(=O)(O)O MCULE-6684762988 [2,0,0,0,0,0|1,0,0]=3 71 B6R0.5 NCCP(=O)(O)O MCULE-6030069631 [2,0,0,0,0,0|0,0,1]=3 72 B6R0.5 NCCP(=O)(O)O MCULE-7710471805 [2,0,0,0,0,0|0,0,1]=3 73 B6R0.5 O=CCS(=O)(=O)O MCULE-1262210475 [2,0,0,0,0,0|1,0,1]=4 74 B6R0.5 O=P(O)(O)CCBr MCULE-3355549967 [2,0,0,0,0,0|1,0,1]=4 75 B6R0.5 O=P(O)(O)CCCl MCULE-4131416773 [2,0,0,0,0,0|1,0,1]=4 76 B6R0.5 O=P(O)(O)CCO MCULE-9752100956 [2,0,0,0,0,0|0,0,1]=3 77 B8R0.5 CCNC(=O)CC(=O)O MCULE-6073095545 [1,1,0,0,0,0|2,0,0]=4 78 B8R0.19 N=C(CC(=O)NO)NO MCULE-4324650628 [1,1,0,0,0,0|2,0,0]=4 79 B8R0.19 O=C(CC(=O)NO)N[O-] MCULE-2570796060 [1,1,0,0,0,0|1,0,1]=4 80 B8R0.19 O=C(CC(=O)NO)N[O-] MCULE-7606204032 [1,1,0,0,0,0|1,0,1]=4 81 B8R0.19 O=C(CO)CC(O)CO MCULE-2853556664 [1,1,0,0,0,0|2,0,0]=4 82 B8R0.23 CN(C)C(=O)CC(=O)O MCULE-6715213324 [1,1,0,0,0,0|2,0,0]=4 83 B8R0.23 O=C(O)CC(=O)C(=O)O MCULE-6059222019 [1,1,0,0,0,0|2,0,0]=4 84 B8R0.29 O=C(O)CCP(=O)(O)O MCULE-5647723204 [1,1,0,0,0,0|1,0,1]=4 85 B8R0.27 CC(C(=O)O)P(=O)(O)O MCULE-8565461015 [1,1,0,0,0,0|0,0,0]=2 86 B8R0.27 CP(=O)(C)C(O)C(=O)O MCULE-6921301874 [1,1,0,0,0,0|2,0,0]=4 87 B8R0.27 O=C(O)C(Cl)P(=O)(O)O MCULE-8492715834 [1,1,0,0,0,0|0,0,0]=2 88 B8R0.27 O=C(O)C(O)P(=O)(O)O MCULE-5564177953 [1,1,0,0,0,0|0,0,0]=2 89 B8R0.33 O=P(O)(O)CP(=O)(O)O MCULE-3698902523 [1,1,0,0,0,0|1,0,0]=3 90 B8R0.33 O=P(O)(O)OP(=O)(O)Cl MCULE-1736654180 [1,1,0,0,0,0|2,0,0]=4 91 B8R0.33 O=P(O)(O)OP(=O)(O)O MCULE-7221126244 [1,1,0,0,0,0|2,0,0]=4 92 B10R0.92 CP(=O)(O)CCC(=O)C(=O)O MCULE-1980572351 [0,1,0,0,0,1|2,0,0]=4 93 B10R0.92 O=C(O)C(=O)COP(=O)(O)O MCULE-6558415212 [0,1,0,0,0,1|1,0,0]=3 94 B10R0.134 COC(=O)CP(=O)(OC)OC MCULE-6039863280 [0,2,0,0,0,0|2,0,0]=4 95 B10R0.31 NC(=CC(=O)O)CP(=O)(O)O MCULE-1305156195 [0,2,0,0,0,0|2,0,0]=4 96 B10R0.31 NC(=O)NC(=O)CP(=O)(O)O MCULE-3971513778 [0,2,0,0,0,0|0,0,1]=3 97 B10R0.31 NC(=O)NC(=O)CP(=O)(O)O MCULE-7873324486 [0,2,0,0,0,0|0,0,1]=3 98 B6R0.3 CNC(=O)C(=O)O MCULE-5436132271 [1,0,0,0,1,0|2,0,0]=4 99 B6R0.3 O=C(O)C(=O)CO MCULE-2263002631 [1,0,0,0,1,0|2,0,0]=4 100 B6R0.7 C=C(C)P(=O)(O)O MCULE-4023318169 [1,0,0,0,1,0|2,0,0]=4 101 B6R0.7 CC(N)P(=O)(O)O MCULE-6335375089 [1,0,0,0,1,0|1,0,1]=4 102 B6R0.7 C[C@@H](N)P(=O)(O)O MCULE-6555656905 [1,0,0,0,1,0|1,0,1]=4 103 B6R0.7 C[C@H](N)P(=O)(O)O MCULE-8139992515 [1,0,0,0,1,0|1,0,1]=4 104 B6R0.7 O=C(O)P(=O)(O)O MCULE-6294437098 [1,0,0,0,1,0|0,0,0]=2 105 B8R0.9 CNC(=O)CCC(=O)O MCULE-8340443315 [1,0,0,0,0,1|2,0,0]=4 106 B8R0.9 CNC(=O)NCC(=O)O MCULE-9575946804 [1,0,0,0,0,1|2,0,0]=4 107 B8R0.9 NNC(=O)CCC(=O)O MCULE-7643180740 [1,0,0,0,0,1|2,0,0]=4 108 B8R0.9 NNC(=O)CCC(=O)O MCULE-9888193887 [1,0,0,0,0,1|2,0,0]=4 109 B8R0.9 NNC(=O)NCC(=O)O MCULE-6013763993 [1,0,0,0,0,1|2,0,0]=4 110 B8R0.9 NNC(=O)NCC(=O)O MCULE-8104731063 [1,0,0,0,0,1|2,0,0]=4 111 B8R0.9 O=C(O)CCC(=O)NO MCULE-2226202964 [1,0,0,0,0,1|1,0,0]=3 112 B8R0.9 O=C(O)COC(=O)CO MCULE-4022202206 [1,0,0,0,0,1|2,0,0]=4 113 B10R0.60 COC(=O)CCCP(=O)(O)O MCULE-1591689771 [0,0,0,0,0,2|2,0,0]=4 114 B10R0.60 COC(=O)CNCP(=O)(O)O MCULE-3846537792 [0,0,0,0,0,2|2,0,0]=4