0 B9R0.47 NCCCCC(N)C(=O)O CS18635 [0,0,0,0,0,0|2,0,0]=2 1 B9R0.47 NCCCCC(N)C(=O)O CS18638 [0,0,0,0,0,0|2,0,0]=2 2 B9R0.47 NCCCCC(N)C(=O)O CS19147 [0,0,0,0,0,0|2,0,0]=2 3 B9R0.47 NCCCCC(N)C(=O)O CS19277 [0,0,0,0,0,0|2,0,0]=2 4 B9R0.47 NCCCCC(N)C(=O)O MC20432 [0,0,0,0,0,0|2,0,0]=2 5 B9R0.47 NCCCCC(N)C(=O)O MC435005 [0,0,0,0,0,0|2,0,0]=2 6 B9R0.47 NCCCCC(N)C(=O)O MC439006 [0,0,0,0,0,0|2,0,0]=2 7 B9R0.47 NCCCCC(N)C(N)=O MC437847 [0,0,0,0,0,0|3,0,0]=3 8 B9R0.47 NCCCCC(N)C(N)=O MC437848 [0,0,0,0,0,0|3,0,0]=3 9 B9R0.47 NCCSCC(N)C(=O)O MC436895 [0,0,0,0,0,0|3,0,0]=3 10 B9R0.47 NC\C=C\CC(N)C(=O)O MC436933 [0,0,0,0,0,0|2,0,2]=4 11 B9R0.47 [N-]=[N+]=NCCC(N)C(=O)O MC436281 [0,0,0,0,0,0|4,0,0]=4 12 B8R0.6 CCCCCC(O)CCl MC114490 [1,0,0,0,0,0|2,0,1]=4 13 B8R0.6 OCCCCC(O)CO MC41917 [1,0,0,0,0,0|2,0,1]=4 14 B8R0.7 CCCCCCB(O)O MC31067 [1,0,0,0,0,0|1,0,1]=3 15 B8R0.7 COCCOCC(=O)O MC10458 [1,0,0,0,0,0|2,0,0]=3 16 B8R0.7 CSCCCCC(=O)O MC112374 [1,0,0,0,0,0|1,0,0]=2 17 B8R0.7 NCCCCCC(=O)O CS13381 [1,0,0,0,0,0|1,0,0]=2 18 B8R0.7 O=C(O)CCCCCBr CS18405 [1,0,0,0,0,0|1,0,0]=2 19 B8R0.8 CCCCC(N)B(O)O MC442653 [1,0,0,0,0,0|2,0,1]=4 20 B8R0.8 CCCCC(N)C(=O)O MC428079 [1,0,0,0,0,0|1,0,0]=2 21 B8R0.8 CCCCC(N)C(=O)O MC428113 [1,0,0,0,0,0|1,0,0]=2 22 B8R0.8 CCCCC(N)C(=O)O MC428121 [1,0,0,0,0,0|1,0,0]=2 23 B8R0.8 CCCCC(N)C(N)=O MC438017 [1,0,0,0,0,0|2,0,0]=3 24 B8R0.8 CSCCC(N)C(=O)O CS18644 [1,0,0,0,0,0|2,0,0]=3 25 B8R0.8 CSCCC(N)C(=O)O MC428038 [1,0,0,0,0,0|2,0,0]=3 26 B8R0.8 CSCCC(N)C(=O)O MC428332 [1,0,0,0,0,0|2,0,0]=3 27 B8R0.8 CSCCC(N)C(N)=O MC437951 [1,0,0,0,0,0|3,0,0]=4 28 B8R0.8 CSCCC(N)C(N)=O MC439009 [1,0,0,0,0,0|3,0,0]=4 29 B8R0.8 C[Se]CCC(N)C(=O)O MC435432 [1,0,0,0,0,0|2,0,0]=3 30 B8R0.8 C[Se]CCC(N)C(=O)O MC435562 [1,0,0,0,0,0|2,0,0]=3 31 B8R0.8 NCCCC(N)C(=O)O CS22279 [1,0,0,0,0,0|2,0,0]=3 32 B8R0.8 NCCCC(N)C(=O)O MC438045 [1,0,0,0,0,0|2,0,0]=3 33 B8R0.8 NCCCC(N)C(=O)O MC439200 [1,0,0,0,0,0|2,0,0]=3 34 B8R0.8 NOCCC(N)C(=O)O MC100566 [1,0,0,0,0,0|3,0,0]=4 35 B8R0.8 NOCCC(N)C(=O)O MC114097 [1,0,0,0,0,0|3,0,0]=4 36 B10R0.42 CCCCNC(C)(C)[P+](=O)O MC20857 [0,1,0,0,0,0|2,0,0]=3 37 B10R0.75 CNCCCCC(N)C(=O)O MC437873 [0,1,0,0,0,0|1,0,0]=2 38 B10R0.82 COC(=O)CCC(N)C(=O)O CS22254 [0,1,0,0,0,0|2,0,1]=4 39 B10R0.82 COC(=O)CCC(N)C(=O)O MC437693 [0,1,0,0,0,0|2,0,1]=4 40 B10R0.82 NCC(O)CCC(N)C(=O)O MC437772 [0,1,0,0,0,0|2,0,0]=3 41 B10R0.83 COC(=O)C(N)CCCCN MC437851 [0,1,0,0,0,0|2,0,0]=3 42 B10R0.86 CNC(CCCCN)C(=O)O MC435480 [0,1,0,0,0,0|1,0,0]=2 43 B10R0.86 CNC(CCCCN)C(=O)O MC437922 [0,1,0,0,0,0|1,0,0]=2 44 B10R0.98 NC(CCCC(=O)O)C(=O)O MC436001 [0,1,0,0,0,0|2,0,1]=4 45 B10R0.98 NC(CCCC(=O)O)C(=O)O MC436002 [0,1,0,0,0,0|2,0,1]=4 46 B10R0.98 NC(CCCC(=O)O)C(=O)O MC436003 [0,1,0,0,0,0|2,0,1]=4 47 B10R1.113 CC1CCNC(C(=O)O)C1 CS13084 [0,0,0,1,0,0|1,0,0]=2 48 B10R1.113 NC1CCCC(C(=O)O)C1 CS14264 [0,0,0,1,0,0|1,0,0]=2 49 B10R1.113 NC1CCCC(C(=O)O)C1 CS17221 [0,0,0,1,0,0|1,0,0]=2 50 B10R1.113 NC1CCCC(C(=O)O)C1 CS17237 [0,0,0,1,0,0|1,0,0]=2 51 B10R1.113 NC1CCCC(C(=O)O)C1 CS19619 [0,0,0,1,0,0|1,0,0]=2 52 B10R1.113 NC1CCCC(C(=O)O)C1 MC105219 [0,0,0,1,0,0|1,0,0]=2 53 B10R1.113 O=C(O)C1CC(O)CCN1 MC445804 [0,0,0,1,0,0|2,0,0]=3 54 B10R1.113 O=C1CCNC(C(=O)O)C1 MC113049 [0,0,0,1,0,0|2,0,1]=4 55 B10R1.113 O=C1CCNC(C(=O)O)C1 MC445805 [0,0,0,1,0,0|2,0,1]=4 56 B10R1.113 O=C1CCNC(C(=O)O)C1 MC445809 [0,0,0,1,0,0|2,0,1]=4 57 B10R1.176 CN1CCC(CN)CC1=O MC444323 [0,0,0,1,0,0|3,0,0]=4 58 B10R1.176 CN1CCC(CO)CC1=O MC112973 [0,0,0,1,0,0|3,0,0]=4 59 B10R1.348 O=C(O)C1CCCCCC1 CS20527 [0,0,0,1,0,0|0,0,0]=1 60 B10R1.363 CC1(C(=O)Cl)CCCCC1 MC425890 [0,0,0,1,0,0|1,0,0]=2 61 B10R1.363 CC1(C(=O)O)CCNCC1 MC429057 [0,0,0,1,0,0|1,0,0]=2 62 B10R1.363 CC1(C(=O)O)CCSCC1 MC104149 [0,0,0,1,0,0|1,0,0]=2 63 B10R1.363 NC1(C(=O)O)CCNCC1 MC105661 [0,0,0,1,0,0|2,0,0]=3 64 B10R1.363 NC1(C(=O)O)CCOCC1 CS14607 [0,0,0,1,0,0|2,0,0]=3 65 B10R1.363 O=C(O)C1(F)CCOCC1 MC102108 [0,0,0,1,0,0|2,0,0]=3 66 B10R0.6 CCCCCC(C)CC(=O)O MC112327 [0,0,0,0,0,1|0,0,0]=1 67 B7R0.1 C=CCCCCCBr CS19607 [2,0,0,0,0,0|2,0,0]=4 68 B7R0.1 COCOCCC=O MC445436 [2,0,0,0,0,0|2,0,0]=4 69 B7R0.1 OCCCCCCBr CS14335 [2,0,0,0,0,0|1,0,1]=4 70 B7R0.4 C#CCCCC(=O)O CS14686 [2,0,0,0,0,0|0,0,2]=4 71 B7R0.4 CC(=O)CCCCBr CS10627 [2,0,0,0,0,0|1,0,1]=4 72 B7R0.4 CC(O)CCCCO MC112436 [2,0,0,0,0,0|1,0,0]=3 73 B7R0.4 CCCCCB(O)O CS22305 [2,0,0,0,0,0|1,0,1]=4 74 B7R0.4 CCCCCC(C)O CS21570 [2,0,0,0,0,0|0,0,0]=2 75 B7R0.4 CCCOCC(=O)O MC425744 [2,0,0,0,0,0|1,0,0]=3 76 B7R0.4 COCCCC(C)N MC112163 [2,0,0,0,0,0|2,0,0]=4 77 B7R0.4 NCCCCC(=O)O MC428108 [2,0,0,0,0,0|1,0,0]=3 78 B7R0.4 NCCNCC(=O)O MC436179 [2,0,0,0,0,0|2,0,0]=4 79 B7R0.4 O=C(O)CCCCBr MC41866 [2,0,0,0,0,0|1,0,0]=3 80 B7R0.5 CCCC(N)C(=O)O CS10518 [2,0,0,0,0,0|1,0,0]=3 81 B7R0.5 CCCC(N)C(=O)O CS17028 [2,0,0,0,0,0|1,0,0]=3 82 B7R0.5 CCCC(N)C(=O)O MC439125 [2,0,0,0,0,0|1,0,0]=3 83 B7R0.5 CCCC(N)C(N)=O MC438024 [2,0,0,0,0,0|2,0,0]=4 84 B7R0.5 COCC(N)C(=O)O CS12183 [2,0,0,0,0,0|2,0,0]=4 85 B7R0.5 COCC(N)C(=O)O CS16755 [2,0,0,0,0,0|2,0,0]=4 86 B7R0.5 COCC(N)C(=O)O CS20335 [2,0,0,0,0,0|2,0,0]=4 87 B7R0.5 CSCC(N)C(=O)O MC439293 [2,0,0,0,0,0|2,0,0]=4 88 B7R0.5 C[Se]CC(N)C(=O)O MC435442 [2,0,0,0,0,0|2,0,0]=4 89 B7R0.5 C[Se]CC(N)C(=O)O MC435443 [2,0,0,0,0,0|2,0,0]=4 90 B7R0.5 NC(CCO)C(=O)O CS13886 [2,0,0,0,0,0|2,0,0]=4 91 B7R0.5 NC(CCO)C(=O)O CS16701 [2,0,0,0,0,0|2,0,0]=4 92 B7R0.5 NC(CCO)C(=O)O CS22620 [2,0,0,0,0,0|2,0,0]=4 93 B7R0.5 NCCC(N)C(=O)O CS13874 [2,0,0,0,0,0|2,0,0]=4 94 B7R0.5 NCCC(N)C(=O)O CS15080 [2,0,0,0,0,0|2,0,0]=4 95 B7R0.5 NCCC(N)C(=O)O MC436921 [2,0,0,0,0,0|2,0,0]=4 96 B7R0.5 NCCC(N)C(=O)O MC439091 [2,0,0,0,0,0|2,0,0]=4 97 B7R0.5 NCCC(N)C(=O)O MC439321 [2,0,0,0,0,0|2,0,0]=4 98 B7R0.5 NCCC(O)C(=O)O CS15496 [2,0,0,0,0,0|2,0,0]=4 99 B7R0.5 NCCC(O)C(=O)O CS21759 [2,0,0,0,0,0|2,0,0]=4 100 B9R0.5 CCCCCC(C)CCBr MC112329 [1,1,0,0,0,0|1,0,1]=4 101 B9R0.5 CCCCCC(C)CCO MC112328 [1,1,0,0,0,0|0,0,1]=3 102 B9R0.2 CCCCCCCC(=O)Cl MC40496 [1,1,0,0,0,0|1,0,0]=3 103 B9R0.2 CCCCCCOC(=O)Cl CS11449 [1,1,0,0,0,0|1,0,0]=3 104 B9R0.2 CCCSCCCC(=O)O MC112372 [1,1,0,0,0,0|0,0,0]=2 105 B9R0.2 NCCCCCCC(=O)O CS10138 [1,1,0,0,0,0|0,0,0]=2 106 B9R0.2 O=C(O)CCCCCCO CS10820 [1,1,0,0,0,0|0,0,0]=2 107 B9R0.2 [N-]=[N+]=NCCCCC(=O)O MC113086 [1,1,0,0,0,0|2,0,0]=4 108 B9R0.4 C[Se]CCC(N)CC(=O)O MC435596 [1,1,0,0,0,0|1,0,0]=3 109 B9R0.4 C[Se]CCC(N)CC(=O)O MC435597 [1,1,0,0,0,0|1,0,0]=3 110 B9R0.38 CCCCCCS(=O)(=O)[O-] MC445020 [1,1,0,0,0,0|1,0,1]=4 111 B9R0.38 CCCCCCS(=O)(=O)[O-] MC445026 [1,1,0,0,0,0|1,0,1]=4 112 B9R0.48 CCCC(C)CCC(=O)O MC112366 [1,1,0,0,0,0|0,0,0]=2 113 B9R0.48 CCOC(=O)CCC(=O)O CS11693 [1,1,0,0,0,0|1,0,1]=4 114 B9R0.7 C=C(C)CCC(N)C(=O)O MC435324 [1,1,0,0,0,0|1,0,1]=4 115 B9R0.7 C=C(C)CCC(N)C(=O)O MC435325 [1,1,0,0,0,0|1,0,1]=4 116 B9R0.7 CC(C)CCC(N)C(=O)O CS10576 [1,1,0,0,0,0|1,0,0]=3 117 B9R0.7 CS(=O)CCC(N)C(=O)O MC437958 [1,1,0,0,0,0|2,0,0]=4 118 B9R0.13 CCCCC(NC)C(=O)O MC435132 [1,1,0,0,0,0|0,0,0]=2 119 B9R0.13 CCCCC(NC)C(=O)O MC435489 [1,1,0,0,0,0|0,0,0]=2 120 B9R0.13 CNC(CCCN)C(=O)O MC435491 [1,1,0,0,0,0|1,0,0]=3 121 B9R0.13 CNC(CCCN)C(=O)O MC435492 [1,1,0,0,0,0|1,0,0]=3 122 B9R0.13 CNC(CCSC)C(=O)O MC435530 [1,1,0,0,0,0|1,0,0]=3 123 B9R0.51 COCCC(C)(N)C(=O)O MC106310 [1,1,0,0,0,0|1,0,0]=3 124 B11R0.2 CCCCCCC(C)CC(=O)O MC112332 [0,1,0,0,0,1|0,0,0]=2 125 B11R0.77 CCCCCC(CC)CC(=O)O MC112331 [0,1,0,0,0,1|0,0,0]=2 126 B11R0.117 CCC(N)C(=O)NC(C)C(=O)O MC112501 [0,2,0,0,0,0|1,0,1]=4 127 B11R0.201 COC(=O)CCC(C)(C)C(=O)O MC112432 [0,2,0,0,0,0|1,0,1]=4 128 B11R0.29 CN(C)CCCCC(N)C(=O)O MC437874 [0,2,0,0,0,0|1,0,0]=3 129 B11R0.29 NC(CCCCC(=O)O)C(=O)O MC436182 [0,2,0,0,0,0|1,0,1]=4 130 B11R0.109 COC(=O)CCCC(N)C(=O)O MC436005 [0,2,0,0,0,0|1,0,1]=4 131 B11R0.141 CCOC(=O)CCC(N)C(=O)O MC437692 [0,2,0,0,0,0|1,0,1]=4 132 B11R0.90 CNC(CCC(=O)OC)C(=O)O MC435465 [0,2,0,0,0,0|1,0,1]=4 133 B11R0.90 CNC(CCC(=O)OC)C(=O)O MC435466 [0,2,0,0,0,0|1,0,1]=4 134 B11R0.75 CNC(CCCCN)C(=O)OC MC435481 [0,2,0,0,0,0|1,0,0]=3 135 B11R0.75 CNC(CCCCN)C(=O)OC MC435482 [0,2,0,0,0,0|1,0,0]=3 136 B11R0.155 CCOC(=O)C(N)CCCCN MC437850 [0,2,0,0,0,0|2,0,0]=4 137 B11R0.78 CCCC(CCCCN)C(=O)O MC116519 [0,2,0,0,0,0|1,0,0]=3 138 B9R1.2 CC1CCCC(CO)N1 MC104326 [1,0,0,1,0,0|1,0,1]=4 139 B9R1.2 CN1CCCC(CO)C1 MC425692 [1,0,0,1,0,0|1,0,1]=4 140 B9R1.3 CN1CCCC(N)C1=O MC103467 [1,0,0,1,0,0|2,0,0]=4 141 B9R1.3 CN1CCCC(N)C1=O MC104792 [1,0,0,1,0,0|2,0,0]=4 142 B9R1.3 CN1CCCC(N)C1=O MC106967 [1,0,0,1,0,0|2,0,0]=4 143 B9R1.3 CN1CCCN(C)C1=O CS14637 [1,0,0,1,0,0|2,0,0]=4 144 B9R1.5 CN1CCCNCC1=O MC100103 [1,0,0,1,0,0|2,0,0]=4 145 B9R1.5 NC1CCCCNC1=O CS15569 [1,0,0,1,0,0|2,0,0]=4 146 B9R1.5 NC1CCCCNC1=O CS15816 [1,0,0,1,0,0|2,0,0]=4 147 B9R1.5 NC1CCCCNC1=O MC425745 [1,0,0,1,0,0|2,0,0]=4 148 B9R1.21 N#CC1CCC(C=O)C1 MC431094 [1,0,0,1,0,0|1,0,1]=4 149 B9R1.89 OCC1CCCCNC1 MC105285 [1,0,0,1,0,0|1,0,1]=4 150 B9R1.118 C#CC1(C)CCCCC1 MC114544 [1,0,0,1,0,0|1,0,1]=4 151 B9R1.118 CC1(CO)CCCNC1 MC444219 [1,0,0,1,0,0|1,0,1]=4 152 B9R1.118 CC1(CO)CCNCC1 CS12640 [1,0,0,1,0,0|1,0,1]=4 153 B9R1.6 CC(=O)C1CCOCC1 CS13055 [1,0,0,1,0,0|2,0,0]=4 154 B9R1.6 NC(=O)C1CCCCN1 MC425161 [1,0,0,1,0,0|2,0,0]=4 155 B9R1.6 NC(=O)C1CCCNC1 CS18298 [1,0,0,1,0,0|2,0,0]=4 156 B9R1.6 NC(=O)C1CCCNC1 MC103934 [1,0,0,1,0,0|2,0,0]=4 157 B9R1.6 NC(=O)C1CCCNC1 MC105293 [1,0,0,1,0,0|2,0,0]=4 158 B9R1.6 NC(=O)C1CCNCC1 CS22309 [1,0,0,1,0,0|2,0,0]=4 159 B9R1.6 O=C(O)C1CC=CCC1 MC20590 [1,0,0,1,0,0|0,0,2]=4 160 B9R1.6 O=C(O)C1CC=CCC1 MC20996 [1,0,0,1,0,0|0,0,2]=4 161 B9R1.6 O=C(O)C1CCCCC1 CS16426 [1,0,0,1,0,0|0,0,0]=2 162 B9R1.6 O=C(O)C1CCCCN1 CS13937 [1,0,0,1,0,0|1,0,0]=3 163 B9R1.6 O=C(O)C1CCCCN1 CS18416 [1,0,0,1,0,0|1,0,0]=3 164 B9R1.6 O=C(O)C1CCCCN1 CS18418 [1,0,0,1,0,0|1,0,0]=3 165 B9R1.6 O=C(O)C1CCCCN1 CS18433 [1,0,0,1,0,0|1,0,0]=3 166 B9R1.6 O=C(O)C1CCCNC1 CS12538 [1,0,0,1,0,0|1,0,0]=3 167 B9R1.6 O=C(O)C1CCCNC1 CS22802 [1,0,0,1,0,0|1,0,0]=3 168 B9R1.6 O=C(O)C1CCCNC1 CS22806 [1,0,0,1,0,0|1,0,0]=3 169 B9R1.6 O=C(O)C1CCCOC1 CS18526 [1,0,0,1,0,0|1,0,0]=3 170 B9R1.6 O=C(O)C1CCCSC1 MC113062 [1,0,0,1,0,0|1,0,0]=3 171 B9R1.6 O=C(O)C1CCNCC1 CS15208 [1,0,0,1,0,0|1,0,0]=3 172 B9R1.6 O=C(O)C1CCNCC1 CS22807 [1,0,0,1,0,0|1,0,0]=3 173 B9R1.6 O=C(O)C1CCOCC1 CS18392 [1,0,0,1,0,0|1,0,0]=3 174 B9R1.6 O=C(O)C1CNCCN1 CS16953 [1,0,0,1,0,0|2,0,0]=4 175 B9R1.6 O=C(O)C1CNCCN1 CS17152 [1,0,0,1,0,0|2,0,0]=4 176 B9R1.6 O=C(O)C1CNCCN1 CS22631 [1,0,0,1,0,0|2,0,0]=4 177 B9R1.6 O=C(O)C1CNCCN1 CS22824 [1,0,0,1,0,0|2,0,0]=4 178 B9R1.6 O=C(O)C1CNCCO1 CS21703 [1,0,0,1,0,0|2,0,0]=4 179 B9R1.6 O=C(O)C1CNCCO1 MC444042 [1,0,0,1,0,0|2,0,0]=4 180 B9R1.6 O=C(O)C1CNCCO1 MC444064 [1,0,0,1,0,0|2,0,0]=4 181 B9R1.6 O=C(O)C1COCCN1 CS16814 [1,0,0,1,0,0|2,0,0]=4 182 B9R1.6 O=C(O)C1COCCN1 CS17811 [1,0,0,1,0,0|2,0,0]=4 183 B9R1.6 O=C(O)C1CSCCN1 CS19640 [1,0,0,1,0,0|2,0,0]=4 184 B9R1.6 OB(O)C1CCCCC1 CS18573 [1,0,0,1,0,0|1,0,1]=4 185 B9R1.13 O=C(Cl)OC1CCCC1 CS11187 [1,0,0,1,0,0|2,0,0]=4 186 B9R1.13 O=C(O)CC1CCCC1 MC112805 [1,0,0,1,0,0|0,0,0]=2 187 B9R1.13 O=C(O)CC1CCCN1 MC106679 [1,0,0,1,0,0|1,0,0]=3 188 B9R1.13 O=C(O)CC1CCNC1 MC104574 [1,0,0,1,0,0|1,0,0]=3 189 B9R1.13 O=C(O)CC1CCNC1 MC105475 [1,0,0,1,0,0|1,0,0]=3 190 B9R1.13 O=C(O)CC1CCOC1 CS20367 [1,0,0,1,0,0|1,0,0]=3 191 B9R1.41 CN1CCCC1C(=O)O CS11794 [1,0,0,1,0,0|1,0,0]=3 192 B9R1.41 CN1CCCC1C(=O)O MC437939 [1,0,0,1,0,0|1,0,0]=3 193 B9R1.41 O=C(O)C1NCCC1O MC105345 [1,0,0,1,0,0|2,0,0]=4 194 B9R1.41 O=C(O)C1NCCC1O MC105346 [1,0,0,1,0,0|2,0,0]=4 195 B9R1.41 O=C(O)C1NCCC1O MC105412 [1,0,0,1,0,0|2,0,0]=4 196 B9R1.84 O=C(O)COC1CCC1 MC33255 [1,0,0,1,0,0|1,0,0]=3 197 B9R1.35 CC1CNC(C(=O)O)C1 MC100332 [1,0,0,1,0,0|1,0,0]=3 198 B9R1.35 CN1CCC(C(=O)O)C1 CS18297 [1,0,0,1,0,0|1,0,0]=3 199 B9R1.35 CN1CCC(C(=O)O)C1 MC103798 [1,0,0,1,0,0|1,0,0]=3 200 B9R1.35 CN1CCC(C(=O)O)C1 MC104573 [1,0,0,1,0,0|1,0,0]=3 201 B9R1.35 CN1CCC(C(=O)O)C1 MC444131 [1,0,0,1,0,0|1,0,0]=3 202 B9R1.35 NC1CCC(C(=O)O)C1 CS14934 [1,0,0,1,0,0|1,0,0]=3 203 B9R1.35 NC1CCC(C(=O)O)C1 CS16161 [1,0,0,1,0,0|1,0,0]=3 204 B9R1.35 NC1CCC(C(=O)O)C1 CS17903 [1,0,0,1,0,0|1,0,0]=3 205 B9R1.35 NC1CCC(C(=O)O)C1 MC105619 [1,0,0,1,0,0|1,0,0]=3 206 B9R1.35 O=C(O)C1CC(F)CN1 MC104337 [1,0,0,1,0,0|2,0,0]=4 207 B9R1.35 O=C(O)C1CC(F)CN1 MC113882 [1,0,0,1,0,0|2,0,0]=4 208 B9R1.35 O=C(O)C1CC(F)CN1 MC437016 [1,0,0,1,0,0|2,0,0]=4 209 B9R1.35 O=C(O)C1CC(F)CN1 MC437017 [1,0,0,1,0,0|2,0,0]=4 210 B9R1.35 O=C(O)C1CC(F)CN1 MC444013 [1,0,0,1,0,0|2,0,0]=4 211 B9R1.35 O=C(O)C1CC(O)CN1 CS12039 [1,0,0,1,0,0|2,0,0]=4 212 B9R1.35 O=C(O)C1CC(O)CN1 CS18304 [1,0,0,1,0,0|2,0,0]=4 213 B9R1.35 O=C(O)C1CC(O)CN1 CS19994 [1,0,0,1,0,0|2,0,0]=4 214 B9R1.35 O=C(O)C1CC(O)CN1 CS22793 [1,0,0,1,0,0|2,0,0]=4 215 B9R1.35 O=C(O)C1CC(O)CN1 MC31144 [1,0,0,1,0,0|2,0,0]=4 216 B9R1.35 O=C(O)C1CC(O)CN1 MC437781 [1,0,0,1,0,0|2,0,0]=4 217 B9R1.35 O=C(O)C1CC(O)CN1 MC437782 [1,0,0,1,0,0|2,0,0]=4 218 B9R1.35 O=C(O)C1CC(S)CN1 MC112474 [1,0,0,1,0,0|2,0,0]=4 219 B9R1.35 O=C1CCC(C(=O)O)C1 CS19439 [1,0,0,1,0,0|1,0,1]=4 220 B9R1.35 O=C1CCC(C(=O)O)C1 MC105133 [1,0,0,1,0,0|1,0,1]=4 221 B9R1.35 O=C1CCC(C(=O)O)C1 MC105627 [1,0,0,1,0,0|1,0,1]=4 222 B9R1.95 COC1CC(C(=O)O)C1 MC102156 [1,0,0,1,0,0|1,0,0]=3 223 B9R1.95 COC1CC(C(=O)O)C1 MC103811 [1,0,0,1,0,0|1,0,0]=3 224 B9R1.95 NCC1CC(C(=O)O)C1 MC105165 [1,0,0,1,0,0|1,0,0]=3 225 B9R1.95 O=C(O)C1CC(CO)C1 MC103733 [1,0,0,1,0,0|1,0,0]=3 226 B9R1.110 NC(C(=O)O)C1CCC1 MC444160 [1,0,0,1,0,0|1,0,0]=3 227 B9R1.110 NC(C(=O)O)C1CCC1 MC444508 [1,0,0,1,0,0|1,0,0]=3 228 B9R1.110 NC(C(=O)O)C1COC1 MC101964 [1,0,0,1,0,0|2,0,0]=4 229 B9R1.112 CC(NC1CC1)C(=O)O MC436876 [1,0,0,1,0,0|1,0,0]=3 230 B9R1.112 NC(CC1CC1)C(=O)O CS18682 [1,0,0,1,0,0|1,0,0]=3 231 B9R1.163 CC1(C(=O)O)CCCN1 MC10549 [1,0,0,1,0,0|1,0,0]=3 232 B9R1.163 CC1(C(=O)O)CCCN1 MC437940 [1,0,0,1,0,0|1,0,0]=3 233 B9R1.163 CC1(C(=O)O)CCOC1 MC103813 [1,0,0,1,0,0|1,0,0]=3 234 B9R1.163 NC(=O)C1(N)CCCC1 CS18509 [1,0,0,1,0,0|2,0,0]=4 235 B9R1.163 NC1(C(=O)O)CCCC1 CS18420 [1,0,0,1,0,0|1,0,0]=3 236 B9R1.163 NC1(C(=O)O)CCOC1 MC20730 [1,0,0,1,0,0|2,0,0]=4 237 B9R1.163 O=C(O)C1(F)CCCC1 MC443736 [1,0,0,1,0,0|1,0,0]=3 238 B9R1.163 O=C(O)C1(F)CCNC1 MC104696 [1,0,0,1,0,0|2,0,0]=4 239 B9R1.163 O=C(O)C1(O)CCCC1 CS20733 [1,0,0,1,0,0|1,0,0]=3 240 B11R1.157 O=C(O)CN1CCCC(O)C1 MC106217 [0,0,0,1,0,1|2,0,0]=4 241 B11R1.157 O=C(O)CN1CCCC(O)C1 MC106218 [0,0,0,1,0,1|2,0,0]=4 242 B11R1.928 NC1(CC(=O)O)CCCCC1 CS12111 [0,0,0,1,0,1|1,0,0]=3 243 B11R1.35 NC(CC1CCCC1)C(=O)O CS11200 [0,1,0,1,0,0|1,0,0]=3 244 B11R1.35 NC(CC1CCCC1)C(=O)O MC436875 [0,1,0,1,0,0|1,0,0]=3 245 B11R1.35 NC(CC1CCCC1)C(=O)O MC439221 [0,1,0,1,0,0|1,0,0]=3 246 B11R1.173 O=C(O)C(F)(F)C1CCCC1 MC431515 [0,1,0,1,0,0|1,0,0]=3 247 B11R1.991 CCCOCC1(C(=O)O)CC1 MC116562 [0,1,0,1,0,0|1,0,0]=3 248 B11R1.36 CC(=O)N(C)C1CCCNC1 MC104146 [0,1,0,1,0,0|2,0,0]=4 249 B11R1.36 CC(=O)N(C)C1CCCNC1 MC105309 [0,1,0,1,0,0|2,0,0]=4 250 B11R1.36 NC(C(=O)O)C1CCCCC1 CS19145 [0,1,0,1,0,0|1,0,0]=3 251 B11R1.36 NC(C(=O)O)C1CCCCC1 CS20539 [0,1,0,1,0,0|1,0,0]=3 252 B11R1.36 NC(C(=O)O)C1CCCCC1 MC436873 [0,1,0,1,0,0|1,0,0]=3 253 B11R1.36 NC(C(=O)O)C1CCOCC1 CS11538 [0,1,0,1,0,0|1,0,0]=3 254 B11R1.36 NC(C(=O)O)C1CCOCC1 CS19119 [0,1,0,1,0,0|1,0,0]=3 255 B11R1.36 NC(C(=O)O)C1CCOCC1 MC116179 [0,1,0,1,0,0|1,0,0]=3 256 B11R1.266 COC1CCNC(C(=O)O)C1 MC431423 [0,1,0,1,0,0|1,0,0]=3 257 B11R1.266 COC1CCNC(C(=O)O)C1 MC431424 [0,1,0,1,0,0|1,0,0]=3 258 B11R1.23 COC(=O)C1CC(O)CCN1 MC100399 [0,1,0,1,0,0|2,0,0]=4 259 B11R1.23 COC(=O)C1CC(O)CCN1 MC445802 [0,1,0,1,0,0|2,0,0]=4 260 B11R1.23 COC(=O)C1CC(O)CCN1 MC445803 [0,1,0,1,0,0|2,0,0]=4 261 B11R1.23 COC(=O)C1CCCN(C)C1 CS20533 [0,1,0,1,0,0|1,0,0]=3 262 B11R1.23 COC(=O)C1CCNC(C)C1 MC102121 [0,1,0,1,0,0|1,0,0]=3 263 B11R1.23 COC(=O)C1CNCC(C)C1 MC102805 [0,1,0,1,0,0|1,0,0]=3 264 B11R1.23 COC(=O)C1CNCC(O)C1 MC111725 [0,1,0,1,0,0|2,0,0]=4 265 B11R1.31 COC(=O)C(N)C1CCCC1 MC428061 [0,1,0,1,0,0|1,0,0]=3 266 B11R1.44 COC(=O)C1CCC(CN)O1 MC115807 [0,1,0,1,0,0|2,0,0]=4 267 B11R1.852 COC(=O)C1CCCNCC1 MC104967 [0,1,0,1,0,0|1,0,0]=3 268 B11R1.878 COC(=O)C1(C)CCCNC1 MC121177 [0,1,0,1,0,0|1,0,0]=3 269 B11R1.878 COC(=O)C1(C)CCCNC1 MC444539 [0,1,0,1,0,0|1,0,0]=3 270 B11R1.878 COC(=O)C1(C)COCCN1 MC103775 [0,1,0,1,0,0|2,0,0]=4 271 B11R1.878 COC(=O)C1(F)CCOCC1 MC114904 [0,1,0,1,0,0|2,0,0]=4 272 B11R1.878 COC(=O)C1(O)CCNCC1 MC107770 [0,1,0,1,0,0|2,0,0]=4 273 B11R1.1074 COC1(C(=O)O)CCOCC1 MC111161 [0,1,0,1,0,0|1,0,0]=3 274 B11R1.175 O=C(O)C1CCC(C(=O)O)C1 MC429806 [0,1,0,1,0,0|1,0,1]=4 275 B11R2.141 O=C(O)C1CC12CCNC2 MC104780 [0,0,0,2,0,0|1,0,0]=3 276 B11R2.845 O=C(O)C1CC2C=CC1C2 CS13550 [0,0,0,2,0,0|0,0,2]=4 277 B11R2.845 O=C(O)C1CC2CCC1C2 MC443337 [0,0,0,2,0,0|0,0,0]=2 278 B11R2.845 O=C(O)C1NC2CCC1C2 MC105636 [0,0,0,2,0,0|1,0,0]=3 279 B11R2.845 O=C(O)C1NC2CCC1C2 MC105637 [0,0,0,2,0,0|1,0,0]=3 280 B11R2.1839 O=C(O)C12CCN(CC1)C2 MC441002 [0,0,0,2,0,0|1,0,0]=3 281 B11R2.1826 O=C(O)C12CC(CCN1)C2 MC105089 [0,0,0,2,0,0|1,0,0]=3 282 B11R2.1826 O=C(O)C12CC(CCN1)C2 MC105095 [0,0,0,2,0,0|1,0,0]=3 283 B11R2.1867 O=C(O)C1CC2(CNC2)C1 MC105247 [0,0,0,2,0,0|1,0,0]=3 284 B11R2.1867 O=C(O)C1CC2(CNC2)C1 MC113174 [0,0,0,2,0,0|1,0,0]=3 285 B11R2.1867 O=C(O)C1CC2(CNC2)C1 MC444166 [0,0,0,2,0,0|1,0,0]=3 286 B11R2.1867 O=C(O)C1CC2(COC2)C1 MC102489 [0,0,0,2,0,0|1,0,0]=3