0 B9R0.56 CC(C)(C)CNCC(=O)O MCULE-1268208354 [0,0,0,0,0,0|4,0,0]=4 1 B9R0.56 CC(C)(C)CNCC(=O)O MCULE-5430860345 [0,0,0,0,0,0|4,0,0]=4 2 B9R0.56 CS(=O)(=O)CCCC(=O)O MCULE-2515518184 [0,0,0,0,0,0|3,0,1]=4 3 B9R0.56 NS(=O)(=O)CCCC(=O)O MCULE-8548216682 [0,0,0,0,0,0|3,0,1]=4 4 B9R0.56 O=C(O)CCCP(=O)(O)O MCULE-9510971866 [0,0,0,0,0,0|1,0,0]=1 5 B9R0.56 O=C(O)CNCC(F)(F)F MCULE-4901432382 [0,0,0,0,0,0|4,0,0]=4 6 B9R0.56 O=C(O)CNCC(F)(F)F MCULE-8079486959 [0,0,0,0,0,0|4,0,0]=4 7 B9R0.56 O=C(O)CNCP(=O)(O)O MCULE-3308266821 [0,0,0,0,0,0|0,0,0]=0 8 B9R0.56 O=C([O-])CNCP(=O)(O)O MCULE-8648426476 [0,0,0,0,0,0|0,0,1]=1 9 B8R0.21 NCCCCP(=O)(O)O MCULE-2632534074 [1,0,0,0,0,0|2,0,1]=4 10 B8R0.21 O=P(O)(O)CCCCBr MCULE-5686227952 [1,0,0,0,0,0|2,0,1]=4 11 B8R0.28 CC(=O)CCCC(=O)O MCULE-2498129200 [1,0,0,0,0,0|3,0,0]=4 12 B8R0.28 CC(C)CNCC(=O)O MCULE-4695293444 [1,0,0,0,0,0|3,0,0]=4 13 B8R0.28 CC(C)CNCC(=O)O MCULE-9936739681 [1,0,0,0,0,0|3,0,0]=4 14 B8R0.28 CC(O)CCCC(=O)O MCULE-6696855762 [1,0,0,0,0,0|3,0,0]=4 15 B8R0.28 NC(=O)CCCC(=O)O MCULE-9714346244 [1,0,0,0,0,0|3,0,0]=4 16 B8R0.28 NC(=O)CNCC(=O)N MCULE-7451569201 [1,0,0,0,0,0|3,0,0]=4 17 B8R0.28 NC(=O)CNCC(=O)O MCULE-2816922286 [1,0,0,0,0,0|2,0,0]=3 18 B8R0.28 NC(=O)COCC(=O)O MCULE-3868584388 [1,0,0,0,0,0|3,0,0]=4 19 B8R0.28 NC(=O)CSCC(=O)O MCULE-1419621262 [1,0,0,0,0,0|3,0,0]=4 20 B8R0.28 O=C(O)/C=C/CC(=O)O MCULE-3754065542 [1,0,0,0,0,0|2,0,1]=4 21 B8R0.28 O=C(O)C=CCC(=O)O MCULE-2034660220 [1,0,0,0,0,0|2,0,1]=4 22 B8R0.28 O=C(O)CCCC(=O)O MCULE-4286022994 [1,0,0,0,0,0|2,0,0]=3 23 B8R0.28 O=C(O)CCCN(=O)=O MCULE-2601801792 [1,0,0,0,0,0|1,1,1]=4 24 B8R0.28 O=C(O)CNCC(=O)O MCULE-4131542591 [1,0,0,0,0,0|1,0,0]=2 25 B8R0.28 O=C(O)COCC(=O)O MCULE-5687758679 [1,0,0,0,0,0|2,0,0]=3 26 B8R0.28 O=C(O)CSCC(=O)O MCULE-8112166808 [1,0,0,0,0,0|2,0,0]=3 27 B8R0.28 O=C([O-])CNCC(=O)[O-] MCULE-1067264838 [1,0,0,0,0,0|1,0,2]=4 28 B8R0.28 O=C([O-])COCC(=O)O MCULE-3773620396 [1,0,0,0,0,0|2,0,1]=4 29 B8R0.28 O=C([O-])COCC(=O)O MCULE-5768077440 [1,0,0,0,0,0|2,0,1]=4 30 B10R0.12 O=C(O)CCC(=O)P(=O)(O)O MCULE-3743459791 [0,1,0,0,0,0|1,0,1]=3 31 B10R0.31 NC(=CC(=O)O)CP(=O)(O)O MCULE-1305156195 [0,1,0,0,0,0|1,0,1]=3 32 B10R0.31 NC(=O)NC(=O)CP(=O)(O)O MCULE-3971513778 [0,1,0,0,0,0|3,0,0]=4 33 B10R0.31 NC(=O)NC(=O)CP(=O)(O)O MCULE-7873324486 [0,1,0,0,0,0|3,0,0]=4 34 B10R0.60 COC(=O)CCCP(=O)(O)O MCULE-1591689771 [0,1,0,0,0,0|1,0,0]=2 35 B10R0.60 COC(=O)CNCP(=O)(O)O MCULE-3846537792 [0,1,0,0,0,0|0,0,0]=1 36 B10R0.60 O=CN(O)CCCP(=O)(O)O MCULE-2546868747 [0,1,0,0,0,0|2,0,0]=3 37 B10R0.60 O=CN(O)CCCP(=O)([O-])O MCULE-1343930312 [0,1,0,0,0,0|2,0,1]=4 38 B10R0.65 COC(C)(C)CNCC(=O)O MCULE-5956151819 [0,1,0,0,0,0|3,0,0]=4 39 B10R0.92 CP(=O)(O)CCC(=O)C(=O)O MCULE-1980572351 [0,1,0,0,0,0|2,0,1]=4 40 B10R0.92 CP(=O)(O)CCC(N)C(=O)O MCULE-1038057082 [0,1,0,0,0,0|2,0,0]=3 41 B10R0.92 CP(=O)(O)CCC(N)C(=O)O MCULE-7761179555 [0,1,0,0,0,0|2,0,0]=3 42 B10R0.92 NC(CCP(=O)(O)O)C(=O)O MCULE-2756478197 [0,1,0,0,0,0|1,0,0]=2 43 B10R0.92 NC(CCS(=O)(=O)O)C(=O)O MCULE-7377602601 [0,1,0,0,0,0|2,0,1]=4 44 B10R0.92 NC(COP(=O)(O)O)C(=O)O MCULE-1695816394 [0,1,0,0,0,0|2,0,0]=3 45 B10R0.92 N[C@@H](CCP(=O)(O)O)C(=O)O MCULE-3863533502 [0,1,0,0,0,0|1,0,0]=2 46 B10R0.92 N[C@@H](CCP(=O)(O)O)C(=O)O MCULE-3988880216 [0,1,0,0,0,0|1,0,0]=2 47 B10R0.92 N[C@@H](CCS(=O)(=O)O)C(=O)O MCULE-8204260402 [0,1,0,0,0,0|2,0,1]=4 48 B10R0.92 N[C@@H](COP(=O)(O)O)C(=O)O MCULE-3199737084 [0,1,0,0,0,0|2,0,0]=3 49 B10R0.92 N[C@@H](COP(=O)(O)O)C(=O)O MCULE-4907212979 [0,1,0,0,0,0|2,0,0]=3 50 B10R0.92 N[C@H](CCP(=O)(O)O)C(=O)O MCULE-4319868114 [0,1,0,0,0,0|1,0,0]=2 51 B10R0.92 N[C@H](CCP(=O)([O-])O)C(=O)O MCULE-5292220353 [0,1,0,0,0,0|1,0,1]=3 52 B10R0.92 N[C@H](COP(=O)(O)O)C(=O)O MCULE-4002733556 [0,1,0,0,0,0|2,0,0]=3 53 B10R0.92 N[C@H](COP(=O)(O)O)C(=O)O MCULE-5554704102 [0,1,0,0,0,0|2,0,0]=3 54 B10R0.92 O=C(O)C(=O)COP(=O)(O)O MCULE-6558415212 [0,1,0,0,0,0|2,0,1]=4 55 B10R0.92 O=C(O)C(O)COP(=O)(O)O MCULE-4022388447 [0,1,0,0,0,0|2,0,0]=3 56 B10R0.92 O=C([O-])C(O)COP(=O)(O)O MCULE-5885787577 [0,1,0,0,0,0|2,0,1]=4 57 B10R0.113 O=P(O)(O)CCCP(=O)(O)O MCULE-6593590984 [0,1,0,0,0,0|2,0,0]=3 58 B10R0.113 O=P(O)(O)CNCP(=O)(O)O MCULE-9667516901 [0,1,0,0,0,0|1,0,0]=2 59 B10R1.307 O=P1(CCCP(=O)(C1)O)O MCULE-1671228402 [0,0,0,1,0,0|3,0,0]=4 60 B8R0.29 CC(=O)NCP(=O)(O)O MCULE-6441383987 [0,0,0,0,1,0|1,0,0]=2 61 B8R0.29 CP(=O)(C)CCC(=O)O MCULE-4161237740 [0,0,0,0,1,0|2,0,0]=3 62 B8R0.29 CP(=O)(O)CCC(=O)O MCULE-7722406670 [0,0,0,0,1,0|1,0,0]=2 63 B8R0.29 CP(=S)(C)CCC(=O)O MCULE-5422068119 [0,0,0,0,1,0|2,1,0]=4 64 B8R0.29 CS(=O)(=O)CCC(=O)O MCULE-6100062469 [0,0,0,0,1,0|2,0,1]=4 65 B8R0.29 CS(=O)(=O)NCC(=O)O MCULE-6239662408 [0,0,0,0,1,0|2,0,1]=4 66 B8R0.29 NS(=O)(=O)CCC(=O)O MCULE-7062523969 [0,0,0,0,1,0|2,0,1]=4 67 B8R0.29 O=C(O)CCP(=O)(O)O MCULE-5647723204 [0,0,0,0,1,0|0,0,0]=1 68 B8R0.29 O=C(O)CCS(=O)(=O)O MCULE-8973025218 [0,0,0,0,1,0|1,0,1]=3 69 B8R0.29 O=C([O-])CC[Si](O)(O)O MCULE-2020093645 [0,0,0,0,1,0|1,0,2]=4 70 B8R0.29 O=C([O-])CC[Si](O)(O)O MCULE-4188223321 [0,0,0,0,1,0|1,0,2]=4 71 B10R0.15 NC(=O)CNCCS(=O)(=O)O MCULE-4191456438 [0,0,0,0,0,1|2,0,1]=4 72 B10R0.15 O=C(O)CCCCP(=O)(O)O MCULE-9230270330 [0,0,0,0,0,1|1,0,0]=2 73 B7R0.4 C#CCNCC(=O)O MCULE-3308171795 [2,0,0,0,0,0|2,0,0]=4 74 B7R0.4 C#CCNCC(=O)O MCULE-7200045848 [2,0,0,0,0,0|2,0,0]=4 75 B7R0.4 C=CCNCC(=O)O MCULE-2925626447 [2,0,0,0,0,0|2,0,0]=4 76 B7R0.4 C=CCNCC(=O)O MCULE-6980667867 [2,0,0,0,0,0|2,0,0]=4 77 B7R0.4 CCCNCC(=O)O MCULE-4384128915 [2,0,0,0,0,0|2,0,0]=4 78 B7R0.4 CCCNCC(=O)O MCULE-7537317046 [2,0,0,0,0,0|2,0,0]=4 79 B7R0.4 NCCNCC(=O)O MCULE-9689592343 [2,0,0,0,0,0|2,0,0]=4 80 B7R0.4 NCCNCC(=O)O MCULE-9795251557 [2,0,0,0,0,0|2,0,0]=4 81 B7R0.4 O=C(O)CCCCO MCULE-8816195933 [2,0,0,0,0,0|2,0,0]=4 82 B7R0.4 O=C(O)CNCCO MCULE-7501311949 [2,0,0,0,0,0|1,0,0]=3 83 B7R0.4 O=C(O)COCCO MCULE-8297137880 [2,0,0,0,0,0|2,0,0]=4 84 B7R0.4 O=C(O)CSCCO MCULE-1062560307 [2,0,0,0,0,0|2,0,0]=4 85 B7R0.4 O=CCCCC(=O)O MCULE-8389457571 [2,0,0,0,0,0|2,0,0]=4 86 B7R0.8 CCCCP(=O)(O)O MCULE-8779445551 [2,0,0,0,0,0|1,0,1]=4 87 B7R0.8 NCCCP(=O)(O)O MCULE-7175026527 [2,0,0,0,0,0|1,0,1]=4 88 B7R0.8 O=P(O)(O)CCCBr MCULE-8428985634 [2,0,0,0,0,0|1,0,1]=4 89 B7R0.8 O=P(O)(O)CCCCl MCULE-9259107636 [2,0,0,0,0,0|1,0,1]=4 90 B9R0.21 O=CC(O)COP(=O)(O)O MCULE-3089825671 [1,1,0,0,0,0|2,0,0]=4 91 B9R0.21 O=C[C@@H](O)COP(=O)(O)O MCULE-2424291446 [1,1,0,0,0,0|2,0,0]=4 92 B9R0.1 COC(=O)CCCC(=O)O MCULE-9458960872 [1,1,0,0,0,0|2,0,0]=4 93 B9R0.1 COC(=O)CNCC(=O)O MCULE-2471794774 [1,1,0,0,0,0|1,0,0]=3 94 B9R0.1 COC(=O)COCC(=O)O MCULE-7342647633 [1,1,0,0,0,0|2,0,0]=4 95 B9R0.1 COC(=O)CSCC(=O)O MCULE-3902674048 [1,1,0,0,0,0|2,0,0]=4 96 B9R0.1 O=C(O)CCCC(O)CO MCULE-8338266320 [1,1,0,0,0,0|2,0,0]=4 97 B9R0.7 CC(CCC(=O)O)C(=O)O MCULE-1523371907 [1,1,0,0,0,0|2,0,0]=4 98 B9R0.7 CC(CCC(=O)O)C(=O)O MCULE-1939523418 [1,1,0,0,0,0|2,0,0]=4 99 B9R0.7 CC(NCC(=O)O)C(=O)O MCULE-1111290878 [1,1,0,0,0,0|1,0,0]=3 100 B9R0.7 CC(NCC(=O)O)C(=O)O MCULE-6569987660 [1,1,0,0,0,0|1,0,0]=3 101 B9R0.7 CC(SCC(=O)O)C(=O)O MCULE-8523268796 [1,1,0,0,0,0|2,0,0]=4 102 B9R0.7 C[C@@H](CCC(=O)O)C(=O)O MCULE-7515023265 [1,1,0,0,0,0|2,0,0]=4 103 B9R0.7 C[C@H](CCC(=O)O)C(=O)O MCULE-8441860655 [1,1,0,0,0,0|2,0,0]=4 104 B9R0.7 C[C@H](CCC(=O)O)C(=O)O MCULE-9071150671 [1,1,0,0,0,0|2,0,0]=4 105 B9R0.7 C[C@H](NCC(=O)O)C(=O)O MCULE-1511229567 [1,1,0,0,0,0|1,0,0]=3 106 B9R0.7 C[C@H](NCC(=O)O)C(=O)O MCULE-4530562082 [1,1,0,0,0,0|1,0,0]=3 107 B9R0.7 NC(CCC(=O)O)C(=O)O MCULE-4203507491 [1,1,0,0,0,0|2,0,0]=4 108 B9R0.7 NC(CCC(=O)O)C(=O)O MCULE-4600207704 [1,1,0,0,0,0|2,0,0]=4 109 B9R0.7 NC(CCC(=O)O)C(=O)O MCULE-8107432729 [1,1,0,0,0,0|2,0,0]=4 110 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O MCULE-6077524166 [1,1,0,0,0,0|2,0,0]=4 111 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O MCULE-7201150413 [1,1,0,0,0,0|2,0,0]=4 112 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O MCULE-7328895736 [1,1,0,0,0,0|2,0,0]=4 113 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O MCULE-7782530856 [1,1,0,0,0,0|2,0,0]=4 114 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O MCULE-9447720868 [1,1,0,0,0,0|2,0,0]=4 115 B9R0.7 N[C@@H](CCC(=O)O)C(O)O MCULE-4882070910 [1,1,0,0,0,0|2,0,0]=4 116 B9R0.7 N[C@H](CCC(=O)O)C(=O)O MCULE-5884691541 [1,1,0,0,0,0|2,0,0]=4 117 B9R0.7 N[C@H](CCC(=O)O)C(=O)O MCULE-6647836957 [1,1,0,0,0,0|2,0,0]=4 118 B9R0.7 O=C(O)CCC(Cl)C(=O)O MCULE-8696439839 [1,1,0,0,0,0|2,0,0]=4 119 B9R0.7 O=C(O)CCC(O)C(=O)O MCULE-5732806069 [1,1,0,0,0,0|2,0,0]=4 120 B9R0.7 O=C(O)CC[C@@H](O)C(=O)O MCULE-2990674754 [1,1,0,0,0,0|2,0,0]=4 121 B9R0.7 O=C(O)CC[C@@H](O)C(=O)O MCULE-9463608806 [1,1,0,0,0,0|2,0,0]=4 122 B9R0.7 O=C(O)CC[C@H](Br)C(=O)O MCULE-3541564241 [1,1,0,0,0,0|2,0,0]=4 123 B9R0.7 O=C(O)CC[C@H](Br)C(=O)O MCULE-5484001209 [1,1,0,0,0,0|2,0,0]=4 124 B9R0.7 O=C(O)CC[C@H](Cl)C(=O)O MCULE-4338578978 [1,1,0,0,0,0|2,0,0]=4 125 B9R0.7 O=C(O)CC[C@H](O)C(=O)O MCULE-4494756126 [1,1,0,0,0,0|2,0,0]=4 126 B9R0.7 O=C(O)CNC(=O)C(=O)O MCULE-6181171802 [1,1,0,0,0,0|1,0,1]=4 127 B9R0.7 P(=O)(O)CC[C@H](N)C(=O)O MCULE-2875179933 [1,1,0,0,0,0|1,0,0]=3 128 B9R0.7 [C@H](N)(CCC(=O)O)C(=O)O MCULE-8526087521 [1,1,0,0,0,0|2,0,0]=4 129 B9R0.7 [C@H](O)(CCC(=O)O)C(=O)O MCULE-8564542509 [1,1,0,0,0,0|2,0,0]=4 130 B9R0.53 CC(CC(=O)O)CC(=O)O MCULE-7399673381 [1,1,0,0,0,0|2,0,0]=4 131 B9R0.53 CN(CC(=O)O)CC(=O)O MCULE-6535937676 [1,1,0,0,0,0|1,0,0]=3 132 B9R0.53 CN(CC(=O)O)CC(=O)O MCULE-9119313390 [1,1,0,0,0,0|1,0,0]=3 133 B9R0.53 NC(CC(=O)O)CC(=O)O MCULE-4205352281 [1,1,0,0,0,0|2,0,0]=4 134 B9R0.53 NC(CC(=O)O)CC(=O)O MCULE-5754399431 [1,1,0,0,0,0|2,0,0]=4 135 B9R0.53 NN(CC(=O)O)CC(=O)O MCULE-6707699178 [1,1,0,0,0,0|1,0,0]=3 136 B9R0.53 O=C(O)CC(=O)CC(=O)O MCULE-7760127170 [1,1,0,0,0,0|2,0,0]=4 137 B9R0.53 O=C(O)CC(O)CC(=O)O MCULE-7670149511 [1,1,0,0,0,0|2,0,0]=4 138 B9R0.53 O=C(O)CS(=O)CC(=O)O MCULE-8117628584 [1,1,0,0,0,0|2,0,0]=4 139 B9R0.57 C=C(OP(=O)(O)O)C(=O)O MCULE-3602390360 [0,1,0,0,1,0|1,0,1]=4 140 B9R0.57 C=C(OP(=O)(O)O)C(=O)O MCULE-8044116150 [0,1,0,0,1,0|1,0,1]=4 141 B9R0.57 NC(CP(=O)(O)O)C(=O)O MCULE-3742656954 [0,1,0,0,1,0|0,0,0]=2 142 B9R0.57 NC(CS(=O)(=O)O)C(=O)O MCULE-3360025136 [0,1,0,0,1,0|1,0,1]=4 143 B9R0.57 NC(CS(=O)(=O)O)C(=O)O MCULE-4680118250 [0,1,0,0,1,0|1,0,1]=4 144 B9R0.57 N[C@@H](CP(=O)(O)O)C(=O)O MCULE-6935567843 [0,1,0,0,1,0|0,0,0]=2 145 B9R0.57 N[C@@H](CS(=O)(=O)O)C(=O)O MCULE-1558128725 [0,1,0,0,1,0|1,0,1]=4 146 B9R0.57 N[C@@H](CS(=O)(=O)O)C(=O)O MCULE-6109276112 [0,1,0,0,1,0|1,0,1]=4 147 B9R0.57 O=C(O)C(O)OP(=O)(O)O MCULE-2072428473 [0,1,0,0,1,0|1,0,0]=3 148 B9R0.64 NCP(=O)(O)CCC(=O)O MCULE-8895842344 [0,1,0,0,1,0|1,0,0]=3 149 B9R0.77 O=P(O)(O)CCP(=O)(O)O MCULE-4998633006 [0,1,0,0,1,0|1,0,0]=3 150 B11R0.199 O=P(O)(O)CCCCP(=O)(O)O MCULE-8065281274 [0,1,0,0,0,1|2,0,0]=4 151 B11R0.318 CC(=O)N(O)CCCP(=O)(O)O MCULE-1046565752 [0,1,0,0,0,1|2,0,0]=4 152 B11R0.318 NC(CC=CP(=O)(O)O)C(=O)O MCULE-8316215091 [0,1,0,0,0,1|1,0,1]=4 153 B11R0.318 NC(CCCP(=O)(O)O)C(=O)O MCULE-8623591326 [0,1,0,0,0,1|1,0,0]=3 154 B11R0.318 NC(CCCP(=O)(O)O)C(=O)[O-] MCULE-1190482144 [0,1,0,0,0,1|1,0,1]=4 155 B11R0.318 NC(CCCP(=O)([O-])O)C(=O)O MCULE-7628102703 [0,1,0,0,0,1|1,0,1]=4 156 B11R0.318 N[C@@H](CCCP(=O)(O)O)C(=O)O MCULE-4298011103 [0,1,0,0,0,1|1,0,0]=3 157 B11R0.318 N[C@@H](CCCP(=O)([O-])O)C(=O)O MCULE-2274115416 [0,1,0,0,0,1|1,0,1]=4 158 B11R0.318 N[C@H](CCCP(=O)(O)O)C(=O)O MCULE-4903649245 [0,1,0,0,0,1|1,0,0]=3 159 B11R0.318 N[C@H](CCCP(=O)(O)O)C(=O)O MCULE-6840301080 [0,1,0,0,0,1|1,0,0]=3 160 B11R0.318 [NH3+][C@@H](CCCP(=O)(O)O)C(=O)[O-] MCULE-2958965934 [0,1,0,0,0,1|1,0,1]=4 161 B11R0.274 O=CN(CC(=O)O)CP(=O)(O)O MCULE-3695226542 [0,2,0,0,0,0|0,0,0]=2 162 B11R0.274 O=NN(CC(=O)O)CP(=O)(O)O MCULE-9439249133 [0,2,0,0,0,0|0,0,0]=2 163 B11R0.308 CC(OP(=O)(O)O)C(N)C(=O)O MCULE-3979704333 [0,2,0,0,0,0|2,0,0]=4 164 B11R0.308 C[C@@H](OP(=O)(O)O)[C@H](N)C(=O)O MCULE-3663360571 [0,2,0,0,0,0|2,0,0]=4 165 B11R0.308 C[C@@H](OP(=O)(O)O)[C@H](N)C(=O)O MCULE-4499625523 [0,2,0,0,0,0|2,0,0]=4 166 B11R0.359 CN(CP(=O)(C)O)CP(=O)(C)O MCULE-8655254835 [0,2,0,0,0,0|2,0,0]=4 167 B11R0.429 CC(N)(CCP(=O)(O)O)C(=O)O MCULE-2760958330 [0,2,0,0,0,0|1,0,0]=3 168 B11R0.429 CC(N)(COP(=O)(O)O)C(=O)O MCULE-5462389544 [0,2,0,0,0,0|2,0,0]=4 169 B11R0.429 C[C@@](N)(CCP(=O)(O)O)C(=O)O MCULE-1287669186 [0,2,0,0,0,0|1,0,0]=3 170 B11R0.429 C[C@](N)(CCP(=O)(O)O)C(=O)O MCULE-2264066789 [0,2,0,0,0,0|1,0,0]=3 171 B9R1.19 O=P(O)(O)C1CCCN1 MCULE-1507527616 [1,0,0,1,0,0|1,0,1]=4 172 B9R1.19 O=P(O)(O)C1CCCN1 MCULE-9994872613 [1,0,0,1,0,0|1,0,1]=4 173 B9R1.35 C1(CCC(=O)O1)C(=O)O MCULE-6663255579 [1,0,0,1,0,0|2,0,0]=4 174 B9R1.35 O=C(O)C1CC(CN1)O MCULE-3129945874 [1,0,0,1,0,0|2,0,0]=4 175 B9R1.35 O=C(O)C1CC(CN1)O MCULE-5090896550 [1,0,0,1,0,0|2,0,0]=4 176 B9R1.35 O=C(O)C1OC(CS1)O MCULE-2827262093 [1,0,0,1,0,0|2,0,0]=4 177 B9R1.35 O=C(O)[C@@H]1CC(CN1)O MCULE-9602889253 [1,0,0,1,0,0|2,0,0]=4 178 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-2778155463 [1,0,0,1,0,0|2,0,0]=4 179 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-3005368457 [1,0,0,1,0,0|2,0,0]=4 180 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-3510440810 [1,0,0,1,0,0|2,0,0]=4 181 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-6982589556 [1,0,0,1,0,0|2,0,0]=4 182 B9R1.35 O=C(O)[C@@H]1C[C@@H](CN1)O MCULE-8797295826 [1,0,0,1,0,0|2,0,0]=4 183 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-4157512603 [1,0,0,1,0,0|2,0,0]=4 184 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-5389747201 [1,0,0,1,0,0|2,0,0]=4 185 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-6465399562 [1,0,0,1,0,0|2,0,0]=4 186 B9R1.35 O=C(O)[C@@H]1C[C@H](CN1)O MCULE-7830616263 [1,0,0,1,0,0|2,0,0]=4 187 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-1222229718 [1,0,0,1,0,0|2,0,0]=4 188 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-1998693022 [1,0,0,1,0,0|2,0,0]=4 189 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-3836053642 [1,0,0,1,0,0|2,0,0]=4 190 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-4545441904 [1,0,0,1,0,0|2,0,0]=4 191 B9R1.35 O=C(O)[C@H]1C[C@@H](CN1)O MCULE-8358409700 [1,0,0,1,0,0|2,0,0]=4 192 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-3080568728 [1,0,0,1,0,0|2,0,0]=4 193 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-4521316626 [1,0,0,1,0,0|2,0,0]=4 194 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-5972935636 [1,0,0,1,0,0|2,0,0]=4 195 B9R1.35 O=C(O)[C@H]1C[C@H](CN1)O MCULE-7908625938 [1,0,0,1,0,0|2,0,0]=4 196 B9R1.35 O=C1CCC(O1)C(=O)O MCULE-1992756541 [1,0,0,1,0,0|2,0,0]=4 197 B9R1.35 O=C1CC[C@@H](O1)C(=O)O MCULE-1446049605 [1,0,0,1,0,0|2,0,0]=4 198 B9R1.35 O=C1CC[C@@H](O1)C(=O)O MCULE-6745317325 [1,0,0,1,0,0|2,0,0]=4 199 B9R1.35 O=C1CC[C@H](O1)C(=O)O MCULE-5669975621 [1,0,0,1,0,0|2,0,0]=4 200 B9R1.35 O=C1CC[C@H](O1)C(=O)O MCULE-7113736527 [1,0,0,1,0,0|2,0,0]=4 201 B9R1.35 O=C1CNC(C1)C(=O)O MCULE-7418065190 [1,0,0,1,0,0|2,0,0]=4 202 B9R1.35 O=C1CNC(C1)C(=O)O MCULE-7697956784 [1,0,0,1,0,0|2,0,0]=4 203 B9R1.35 O=C1CNC(C1)C(=O)O MCULE-9520720032 [1,0,0,1,0,0|2,0,0]=4 204 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-2573903934 [1,0,0,1,0,0|2,0,0]=4 205 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-3585746586 [1,0,0,1,0,0|2,0,0]=4 206 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-4771747932 [1,0,0,1,0,0|2,0,0]=4 207 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-4795592072 [1,0,0,1,0,0|2,0,0]=4 208 B9R1.35 O=C1CN[C@@H](C1)C(=O)O MCULE-6928857625 [1,0,0,1,0,0|2,0,0]=4 209 B9R1.35 [C@@H]1(CN[C@H](C1)C(=O)O)O MCULE-3075663401 [1,0,0,1,0,0|2,0,0]=4 210 B9R1.35 [C@H]1(C[C@H](CN1)O)C(=O)O MCULE-3462627258 [1,0,0,1,0,0|2,0,0]=4 211 B9R1.161 O=C(O)C1CC1C(=O)O MCULE-5636831869 [1,0,0,1,0,0|2,0,0]=4 212 B9R1.161 O=C(O)C1OC1C(=O)O MCULE-2308875813 [1,0,0,1,0,0|2,0,0]=4 213 B9R1.161 O=C(O)[C@@H]1C[C@H]1C(=O)O MCULE-2176178577 [1,0,0,1,0,0|2,0,0]=4 214 B9R1.161 O=C(O)[C@@H]1C[C@H]1C(=O)O MCULE-7341169681 [1,0,0,1,0,0|2,0,0]=4 215 B9R1.161 O=C(O)[C@@H]1C[C@H]1C(=O)O MCULE-9766210553 [1,0,0,1,0,0|2,0,0]=4 216 B9R1.161 O=C(O)[C@@H]1O[C@H]1C(=O)O MCULE-2854301838 [1,0,0,1,0,0|2,0,0]=4 217 B9R1.161 O=C(O)[C@@H]1O[C@H]1C(=O)O MCULE-7193163448 [1,0,0,1,0,0|2,0,0]=4 218 B9R1.161 O=C(O)[C@H]1C[C@@H]1C(=O)O MCULE-8230558967 [1,0,0,1,0,0|2,0,0]=4 219 B9R1.161 O=C(O)[C@H]1C[C@@H]1C(=O)O MCULE-9433538416 [1,0,0,1,0,0|2,0,0]=4 220 B9R1.161 O=C(O)[C@H]1C[C@H]1C(=O)O MCULE-4280807741 [1,0,0,1,0,0|2,0,0]=4 221 B9R1.161 O=C(O)[C@H]1O[C@H]1C(=O)O MCULE-6088596771 [1,0,0,1,0,0|2,0,0]=4 222 B7R0.6 CC(=O)CCC(=O)O MCULE-1392778065 [1,0,0,0,1,0|2,0,0]=4 223 B7R0.6 CC(=O)NCC(=O)O MCULE-5811325186 [1,0,0,0,1,0|2,0,0]=4 224 B7R0.6 CC(O)CCC(=O)O MCULE-6352217997 [1,0,0,0,1,0|2,0,0]=4 225 B7R0.6 CS(=O)CCC(=O)O MCULE-8243349779 [1,0,0,0,1,0|2,0,0]=4 226 B7R0.6 NC(=O)CCC(=O)O MCULE-5813999826 [1,0,0,0,1,0|2,0,0]=4 227 B7R0.6 NC(=O)NCC(=O)O MCULE-7640310218 [1,0,0,0,1,0|2,0,0]=4 228 B7R0.6 O=C(O)CCB(O)O MCULE-9351023222 [1,0,0,0,1,0|1,0,0]=3 229 B7R0.6 O=C(O)CCC(=O)O MCULE-1233211613 [1,0,0,0,1,0|1,0,0]=3 230 B7R0.6 O=C(O)CCC(=O)O MCULE-5889111640 [1,0,0,0,1,0|1,0,0]=3 231 B7R0.6 O=C(O)CCN(=O)=O MCULE-1879231817 [1,0,0,0,1,0|0,1,1]=4 232 B7R0.6 O=C([O-])CCC(=O)O MCULE-9149947862 [1,0,0,0,1,0|1,0,1]=4 233 B7R0.9 CC(=O)OP(=O)(O)O MCULE-3093243474 [0,0,0,0,2,0|2,0,0]=4 234 B7R0.9 NC(=O)OP(=O)(O)O MCULE-8071699770 [0,0,0,0,2,0|2,0,0]=4 235 B7R0.9 O=C(O)CP(=O)(O)O MCULE-7055994360 [0,0,0,0,2,0|0,0,0]=2 236 B7R0.9 O=C(O)CS(=O)(=O)O MCULE-4846153382 [0,0,0,0,2,0|1,0,1]=4 237 B9R0.55 O=C(O)C/C=C/CC(=O)O MCULE-6650386294 [1,0,0,0,0,1|2,0,0]=4 238 B9R0.55 O=C(O)CC=CCC(=O)O MCULE-4878757775 [1,0,0,0,0,1|2,0,0]=4 239 B9R0.55 O=C(O)CCCCC(=O)O MCULE-1336748609 [1,0,0,0,0,1|2,0,0]=4 240 B9R0.55 O=C(O)CCCCC(=O)O MCULE-3664126855 [1,0,0,0,0,1|2,0,0]=4 241 B9R0.55 O=C(O)CCCCC(=O)O MCULE-6331125687 [1,0,0,0,0,1|2,0,0]=4 242 B9R0.55 O=C(O)CCCCC(=O)O MCULE-7006255210 [1,0,0,0,0,1|2,0,0]=4 243 B9R0.55 O=C(O)CCCCC(=O)O MCULE-7155960751 [1,0,0,0,0,1|2,0,0]=4 244 B9R0.55 O=C(O)CNNCC(=O)O MCULE-8753369145 [1,0,0,0,0,1|1,0,0]=3 245 B9R0.55 O=C(O)CSSCC(=O)O MCULE-1938189832 [1,0,0,0,0,1|2,0,0]=4 246 B9R0.55 O=C(O)CSSCC(=O)O MCULE-2878758153 [1,0,0,0,0,1|2,0,0]=4 247 B11R0.31 O=C(O)CCCCCP(=O)(O)O MCULE-8946955517 [0,0,0,0,0,2|1,0,0]=3