0 B8R0.2 CCC(C)C(=O)C(=O)O HR136223 [0,0,0,0,0,0|0,0,0]=0 1 B8R0.2 CCC(C)C(=O)C(=O)[O-] HR105983 [0,0,0,0,0,0|0,0,1]=1 2 B8R0.2 CCC(C)C(Cl)C(=O)O HR103573 [0,0,0,0,0,0|1,0,1]=2 3 B8R0.2 CCC(C)C(N)C(=O)O HR122107 [0,0,0,0,0,0|1,0,1]=2 4 B8R0.2 CCC(C)C(N)C(=O)O HR126392 [0,0,0,0,0,0|1,0,1]=2 5 B8R0.2 CCC(C)C(N)C(=O)O HR126596 [0,0,0,0,0,0|1,0,1]=2 6 B8R0.2 CCC(C)C(N)C(=O)O HR129264 [0,0,0,0,0,0|1,0,1]=2 7 B8R0.2 CCC(C)C(N)C(=O)O HR134488 [0,0,0,0,0,0|1,0,1]=2 8 B8R0.2 CCC(C)C(N)C(N)=O HR114403 [0,0,0,0,0,0|2,0,1]=3 9 B8R0.2 COC(C)C(N)C(=O)O HR109877 [0,0,0,0,0,0|2,0,1]=3 10 B8R0.2 COC(C)C(N)C(=O)O HR143103 [0,0,0,0,0,0|2,0,1]=3 11 B8R0.2 O=C(O)C(O)C(O)CO HR18483 [0,0,0,0,0,0|2,0,2]=4 12 B7R0.2 CCC(C)CC(=O)O HR11273 [1,0,0,0,0,0|0,0,1]=2 13 B7R0.2 CCC(C)CC(=O)O HR135865 [1,0,0,0,0,0|0,0,1]=2 14 B7R0.2 CCC(C)NC(N)=O HR114250 [1,0,0,0,0,0|2,0,0]=3 15 B7R0.2 CCC(C)OC(=O)[O-] HR144165 [1,0,0,0,0,0|1,0,1]=3 16 B7R0.2 CCC(N)CC(=O)O HR114631 [1,0,0,0,0,0|1,0,1]=3 17 B7R0.2 CCC(N)CC(=O)O HR143295 [1,0,0,0,0,0|1,0,1]=3 18 B7R0.2 CCC(N)CC(=O)O HR147022 [1,0,0,0,0,0|1,0,1]=3 19 B7R0.2 NCC(O)CC(=O)O HR137304 [1,0,0,0,0,0|2,0,1]=4 20 B7R0.5 CCCC(=O)C(=O)O HR138596 [1,0,0,0,0,0|0,0,0]=1 21 B7R0.5 CCCC(=O)C(C)=O HR139186 [1,0,0,0,0,0|1,0,0]=2 22 B7R0.5 CCCC(=O)C(C)C HR130078 [1,0,0,0,0,0|2,0,1]=4 23 B7R0.5 CCCC(Br)C(=O)Cl HR140278 [1,0,0,0,0,0|2,0,1]=4 24 B7R0.5 CCCC(Br)C(=O)O HR114924 [1,0,0,0,0,0|1,0,1]=3 25 B7R0.5 CCCC(C)C(=O)O HR131664 [1,0,0,0,0,0|1,0,1]=3 26 B7R0.5 CCCC(N)C(=O)O HR122649 [1,0,0,0,0,0|1,0,1]=3 27 B7R0.5 CCCC(N)C(=O)O HR136723 [1,0,0,0,0,0|1,0,1]=3 28 B7R0.5 CCCC(N)C(=O)O HR138486 [1,0,0,0,0,0|1,0,1]=3 29 B7R0.5 CCOC(=O)C(=O)Cl HR138954 [1,0,0,0,0,0|2,0,0]=3 30 B7R0.5 CCOC(=O)C(C)=O HR135005 [1,0,0,0,0,0|2,0,0]=3 31 B7R0.5 CCOC(=O)C(C)O HR100136 [1,0,0,0,0,0|2,0,1]=4 32 B7R0.5 CCOC(=O)C(C)O HR15558 [1,0,0,0,0,0|2,0,1]=4 33 B7R0.5 CCOC(=S)C(N)=O HR125905 [1,0,0,0,0,0|2,1,0]=4 34 B7R0.5 CC\C=C(\C)C(=O)O HR131305 [1,0,0,0,0,0|1,0,1]=3 35 B7R0.5 CC\C=C(\C)C(=O)O HR138938 [1,0,0,0,0,0|1,0,1]=3 36 B7R0.5 CNCC(N)C(=O)O HR146211 [1,0,0,0,0,0|2,0,1]=4 37 B7R0.5 COCC(N)C(=O)O HR108882 [1,0,0,0,0,0|2,0,1]=4 38 B7R0.5 COCC(N)C(=O)O HR109701 [1,0,0,0,0,0|2,0,1]=4 39 B7R0.5 COCC(N)C(=O)O HR110015 [1,0,0,0,0,0|2,0,1]=4 40 B7R0.5 COCC(N)C(=O)O HR115078 [1,0,0,0,0,0|2,0,1]=4 41 B7R0.5 COCC(N)C(=O)O HR115700 [1,0,0,0,0,0|2,0,1]=4 42 B7R0.5 CSCC(N)C(=O)O HR134174 [1,0,0,0,0,0|2,0,1]=4 43 B7R0.5 NC(CCBr)C(=O)O HR102483 [1,0,0,0,0,0|2,0,1]=4 44 B7R0.5 NC(CCO)C(=O)O HR122160 [1,0,0,0,0,0|2,0,1]=4 45 B7R0.5 NC(CCO)C(=O)O HR127129 [1,0,0,0,0,0|2,0,1]=4 46 B7R0.5 NC(CCO)C(=O)O HR129910 [1,0,0,0,0,0|2,0,1]=4 47 B7R0.5 NC(CCS)C(=O)O HR100636 [1,0,0,0,0,0|2,0,1]=4 48 B7R0.5 NC(CCS)C(=O)O HR137923 [1,0,0,0,0,0|2,0,1]=4 49 B7R0.5 NCCC(N)C(=O)O HR112825 [1,0,0,0,0,0|2,0,1]=4 50 B7R0.5 NCCC(N)C(=O)O HR14752 [1,0,0,0,0,0|2,0,1]=4 51 B7R0.5 O=C(O)C(Br)CCBr HR138979 [1,0,0,0,0,0|2,0,1]=4 52 B7R0.10 CCC(Br)C(=O)OC HR123363 [1,0,0,0,0,0|3,0,0]=4 53 B7R0.10 CCC(C)C(=O)OC HR133876 [1,0,0,0,0,0|2,0,0]=3 54 B7R0.10 CCC(C)C(=O)OC HR143721 [1,0,0,0,0,0|2,0,0]=3 55 B7R0.10 CCC(C)C(=O)SC HR105243 [1,0,0,0,0,0|2,0,0]=3 56 B7R0.10 CCC(C)C(N)CO HR103998 [1,0,0,0,0,0|1,0,2]=4 57 B7R0.10 CCC(C)C(N)CO HR123663 [1,0,0,0,0,0|1,0,2]=4 58 B7R0.10 CCC(O)C(=O)OC HR144357 [1,0,0,0,0,0|3,0,0]=4 59 B7R0.10 CCC(S)C(C)C=O HR125292 [1,0,0,0,0,0|2,0,1]=4 60 B7R0.10 COC(=O)C(C)CO HR144262 [1,0,0,0,0,0|3,0,0]=4 61 B7R0.10 O=C(CO)C(O)CO HR100190 [1,0,0,0,0,0|2,0,1]=4 62 B7R0.16 C=C(C)C(=O)N(C)C HR143638 [1,0,0,0,0,0|3,0,0]=4 63 B7R0.16 CC(=O)C(=O)C(C)C HR141113 [1,0,0,0,0,0|1,0,0]=2 64 B7R0.16 CC(Br)C(Br)C(=O)O HR127665 [1,0,0,0,0,0|2,0,1]=4 65 B7R0.16 CC(C)C(=O)C(=O)O HR136485 [1,0,0,0,0,0|0,0,0]=1 66 B7R0.16 CC(C)C(=O)C(=O)[O-] HR127707 [1,0,0,0,0,0|0,0,1]=2 67 B7R0.16 CC(C)C(=O)C(=O)[O-] HR137721 [1,0,0,0,0,0|0,0,1]=2 68 B7R0.16 CC(C)C(Br)C(=O)Br HR136438 [1,0,0,0,0,0|2,0,1]=4 69 B7R0.16 CC(C)C(Br)C(=O)O HR115414 [1,0,0,0,0,0|1,0,1]=3 70 B7R0.16 CC(C)C(Br)C(=O)O HR124122 [1,0,0,0,0,0|1,0,1]=3 71 B7R0.16 CC(C)C(Br)C(=O)O HR137032 [1,0,0,0,0,0|1,0,1]=3 72 B7R0.16 CC(C)C(Cl)C(=O)O HR103881 [1,0,0,0,0,0|1,0,1]=3 73 B7R0.16 CC(C)C(F)C(=O)O HR116661 [1,0,0,0,0,0|1,0,1]=3 74 B7R0.16 CC(C)C(N)C(=O)O HR126445 [1,0,0,0,0,0|1,0,1]=3 75 B7R0.16 CC(C)C(N)C(=O)O HR130729 [1,0,0,0,0,0|1,0,1]=3 76 B7R0.16 CC(C)C(N)C(=O)O HR134362 [1,0,0,0,0,0|1,0,1]=3 77 B7R0.16 CC(C)C(N)C(=O)O HR141699 [1,0,0,0,0,0|1,0,1]=3 78 B7R0.16 CC(C)C(N)C(N)=O HR112915 [1,0,0,0,0,0|2,0,1]=4 79 B7R0.16 CC(C)C(N)C(N)=O HR122778 [1,0,0,0,0,0|2,0,1]=4 80 B7R0.16 CC(C)C(O)C(=O)O HR124143 [1,0,0,0,0,0|0,0,2]=3 81 B7R0.16 CC(O)C(=O)N(C)C HR100956 [1,0,0,0,0,0|2,0,1]=4 82 B7R0.16 CC(O)C(N)C(=O)O HR126335 [1,0,0,0,0,0|2,0,1]=4 83 B7R0.16 CC(O)C(N)C(=O)O HR128851 [1,0,0,0,0,0|2,0,1]=4 84 B7R0.16 CC(O)C(N)C(=O)O HR129391 [1,0,0,0,0,0|2,0,1]=4 85 B7R0.16 CC(O)C(N)C(=O)O HR129491 [1,0,0,0,0,0|2,0,1]=4 86 B7R0.16 CC(O)C(N)C(=O)O HR135216 [1,0,0,0,0,0|2,0,1]=4 87 B7R0.16 CC(O)C(N)C(=O)O HR138779 [1,0,0,0,0,0|2,0,1]=4 88 B7R0.16 CN(C)C(=O)C(=O)O HR118982 [1,0,0,0,0,0|1,0,0]=2 89 B7R0.16 CN(C)C(=O)C(N)=O HR128536 [1,0,0,0,0,0|2,0,0]=3 90 B7R0.16 O=C(O)C(=O)C(=O)O HR145722 [1,0,0,0,0,0|2,0,1]=4 91 B9R0.6 CCOC(C)C(N)C(=O)O HR142223 [0,1,0,0,0,0|1,0,1]=3 92 B9R0.27 CCC(C)C(N)C(=O)OC HR129852 [0,1,0,0,0,0|1,0,1]=3 93 B9R0.27 CCC(C)C(N)C(=O)OC RESA02602 [0,1,0,0,0,0|1,0,1]=3 94 B9R0.29 CCC(C)C(NC)C(=O)O HR117202 [0,1,0,0,0,0|1,0,1]=3 95 B9R0.79 CC(C)C(O)C(N)C(=O)O HR142318 [0,1,0,0,0,0|2,0,1]=4 96 B9R0.79 CC(C)C(O)C(N)C(=O)O HR142415 [0,1,0,0,0,0|2,0,1]=4 97 B9R0.79 CC(C)C(O)C(N)C(=O)O HR142502 [0,1,0,0,0,0|2,0,1]=4 98 B9R0.79 CC(O)C(C)C(N)C(=O)O HR120699 [0,1,0,0,0,0|1,0,1]=3 99 B9R0.79 CC(O)C(C)C(N)C(=O)O HR120942 [0,1,0,0,0,0|1,0,1]=3 100 B9R1.37 CC1=C(O)C(=O)OC1C HR132334 [0,0,0,1,0,0|0,0,2]=3 101 B9R1.37 CC1CC(=O)C(=O)C1C HR124020 [0,0,0,1,0,0|1,0,0]=2 102 B9R1.41 CC1CCNC1C(=O)O HR139699 [0,0,0,1,0,0|1,0,1]=3 103 B9R1.41 CN1CCCC1C(=O)O HR102016 [0,0,0,1,0,0|2,0,1]=4 104 B9R1.41 CN1CCCC1C(=O)O HR139408 [0,0,0,1,0,0|2,0,1]=4 105 B9R1.41 CN1CCCC1C(=O)O HR139601 [0,0,0,1,0,0|2,0,1]=4 106 B9R1.41 CN1CCCC1C(=O)O HR147686 [0,0,0,1,0,0|2,0,1]=4 107 B9R1.41 NC1CCCC1C(=O)O HR11111 [0,0,0,1,0,0|2,0,1]=4 108 B9R1.41 NC1CCCC1C(=O)O HR112426 [0,0,0,1,0,0|2,0,1]=4 109 B9R1.41 NC1CCCC1C(=O)O HR112742 [0,0,0,1,0,0|2,0,1]=4 110 B9R1.41 NC1CCCC1C(=O)O HR113061 [0,0,0,1,0,0|2,0,1]=4 111 B9R1.41 NC1CCCC1C(=O)O HR117553 [0,0,0,1,0,0|2,0,1]=4 112 B9R1.41 O=C(O)C1NCCC1O HR100963 [0,0,0,1,0,0|2,0,1]=4 113 B9R1.41 O=C(O)C1NCCC1O HR146202 [0,0,0,1,0,0|2,0,1]=4 114 B9R1.110 NC(C(=O)O)C1COC1 HR102481 [0,0,0,1,0,0|2,0,1]=4 115 B9R1.132 CCC1=C(O)C(=O)CC1 HR124889 [0,0,0,1,0,0|1,0,2]=4 116 B9R0.23 CCC(C)C(=O)OC(C)C HR139110 [0,0,0,0,0,1|2,0,1]=4 117 B9R0.42 COC(=O)CC(=O)C(=O)O HR32427 [0,0,0,0,0,1|2,0,1]=4 118 B6R0.1 C=CC(=O)CCC HR100488 [2,0,0,0,0,0|1,0,0]=3 119 B6R0.1 CCC(C)CCO HR120273 [2,0,0,0,0,0|0,0,2]=4 120 B6R0.1 CCCC(=O)NN HR113429 [2,0,0,0,0,0|2,0,0]=4 121 B6R0.1 CCCC(=O)SC HR136352 [2,0,0,0,0,0|2,0,0]=4 122 B6R0.1 CCOC(=O)C=O HR130872 [2,0,0,0,0,0|1,0,0]=3 123 B6R0.1 CCOC(=O)CO HR127384 [2,0,0,0,0,0|1,0,1]=4 124 B6R0.1 CSC(C)CC=O HR133413 [2,0,0,0,0,0|1,0,1]=4 125 B6R0.2 CC(=O)NC(C)C ABSA04901 [2,0,0,0,0,0|2,0,0]=4 126 B6R0.2 CC(C)=CC(=O)Cl HR129281 [2,0,0,0,0,0|1,0,1]=4 127 B6R0.2 CC(C)=CC(=O)O HR21295 [2,0,0,0,0,0|0,0,1]=3 128 B6R0.2 CC(C)CC(=O)O HR123359 [2,0,0,0,0,0|0,0,1]=3 129 B6R0.2 CC(C)CC(N)=O HR109732 [2,0,0,0,0,0|1,0,1]=4 130 B6R0.2 CC(N)CC(=O)O HR103780 [2,0,0,0,0,0|1,0,1]=4 131 B6R0.2 CC(N)CC(=O)O HR116211 [2,0,0,0,0,0|1,0,1]=4 132 B6R0.2 CC(N)CC(=O)O HR120488 [2,0,0,0,0,0|1,0,1]=4 133 B6R0.2 CC(N)CC(=O)O HR124863 [2,0,0,0,0,0|1,0,1]=4 134 B6R0.2 CN(C)CC(=O)O HR127289 [2,0,0,0,0,0|1,0,1]=4 135 B6R0.4 CCCCC(=O)Cl HR147689 [2,0,0,0,0,0|1,0,1]=4 136 B6R0.4 CCCCC(=O)[O-] HR143929 [2,0,0,0,0,0|0,0,2]=4 137 B6R0.4 CCCCC(N)=O HR110039 [2,0,0,0,0,0|1,0,1]=4 138 B6R0.4 CCCC[Sn](=O)O HR135371 [2,0,0,0,0,0|1,0,1]=4 139 B6R0.4 CCCSC(C)=O HR137881 [2,0,0,0,0,0|2,0,0]=4 140 B6R0.4 CCNCC(=O)O HR105131 [2,0,0,0,0,0|1,0,1]=4 141 B6R0.4 CCOCC(=O)O HR123178 [2,0,0,0,0,0|1,0,1]=4 142 B6R0.4 CNCCC(=O)O HR100194 [2,0,0,0,0,0|1,0,1]=4 143 B6R0.4 NCCCC(=O)O HR130958 [2,0,0,0,0,0|1,0,1]=4 144 B6R0.4 O=C(O)CCCBr HR131673 [2,0,0,0,0,0|1,0,1]=4 145 B6R0.4 O=C(O)CCCCl HR120152 [2,0,0,0,0,0|1,0,1]=4 146 B6R0.3 C=C(CC)C(=O)O HR118672 [2,0,0,0,0,0|1,0,0]=3 147 B6R0.3 C=CC(=O)N(C)C HR129014 [2,0,0,0,0,0|2,0,0]=4 148 B6R0.3 CC(C)C(=O)CBr HR144939 [2,0,0,0,0,0|1,0,1]=4 149 B6R0.3 CC(C)C(=O)NN HR137490 [2,0,0,0,0,0|2,0,0]=4 150 B6R0.3 CC(CN)C(=O)O HR133030 [2,0,0,0,0,0|1,0,0]=3 151 B6R0.3 CCC(=O)C(=O)O HR128819 [2,0,0,0,0,0|0,0,0]=2 152 B6R0.3 CCC(=O)C(C)=O HR131826 [2,0,0,0,0,0|1,0,0]=3 153 B6R0.3 CCC(Br)C(=O)Cl HR115509 [2,0,0,0,0,0|2,0,0]=4 154 B6R0.3 CCC(Br)C(=O)O HR123595 [2,0,0,0,0,0|1,0,0]=3 155 B6R0.3 CCC(C)C(=O)Cl HR144038 [2,0,0,0,0,0|1,0,0]=3 156 B6R0.3 CCC(C)C(=O)O HR124401 [2,0,0,0,0,0|0,0,0]=2 157 B6R0.3 CCC(C)C(=O)O HR124666 [2,0,0,0,0,0|0,0,0]=2 158 B6R0.3 CCC(C)C(N)=O HR115534 [2,0,0,0,0,0|1,0,0]=3 159 B6R0.3 CCC(Cl)C(=O)O HR104193 [2,0,0,0,0,0|1,0,0]=3 160 B6R0.3 CCC(Cl)C(=O)O HR104505 [2,0,0,0,0,0|1,0,0]=3 161 B6R0.3 CCC(N)C(=O)O HR100731 [2,0,0,0,0,0|1,0,0]=3 162 B6R0.3 CCC(N)C(=O)O HR128531 [2,0,0,0,0,0|1,0,0]=3 163 B6R0.3 CCC(N)C(=O)O HR128797 [2,0,0,0,0,0|1,0,0]=3 164 B6R0.3 CCC(N)C(=O)O HR130831 [2,0,0,0,0,0|1,0,0]=3 165 B6R0.3 CCC(N)C(=O)O VOJL00901 [2,0,0,0,0,0|1,0,0]=3 166 B6R0.3 CCC(N)C(N)=O HR113889 [2,0,0,0,0,0|2,0,0]=4 167 B6R0.3 CCC(N)C(N)=O HR133280 [2,0,0,0,0,0|2,0,0]=4 168 B6R0.3 CCC(O)C(=O)O HR145745 [2,0,0,0,0,0|1,0,0]=3 169 B6R0.3 CCC(O)C(=O)O HR8265 [2,0,0,0,0,0|1,0,0]=3 170 B6R0.3 CCC(S)C(C)=O HR124234 [2,0,0,0,0,0|1,0,1]=4 171 B6R0.3 CCN(C)C(=O)Cl HR16066 [2,0,0,0,0,0|2,0,0]=4 172 B6R0.3 CNC(C)C(=O)O HR126490 [2,0,0,0,0,0|1,0,0]=3 173 B6R0.3 CNC(C)C(=O)O HR131233 [2,0,0,0,0,0|1,0,0]=3 174 B6R0.3 CNC(C)C(=O)O HR138734 [2,0,0,0,0,0|1,0,0]=3 175 B6R0.3 CNC(C)C(=O)[O-] HR145674 [2,0,0,0,0,0|1,0,1]=4 176 B6R0.3 COC(=O)C(=O)Cl FOXF01206 [2,0,0,0,0,0|2,0,0]=4 177 B6R0.3 COC(=O)C(C)=O HR131015 [2,0,0,0,0,0|2,0,0]=4 178 B6R0.3 COC(=O)C(N)=O HR115965 [2,0,0,0,0,0|2,0,0]=4 179 B6R0.3 CSC(C)C(C)=O HR133684 [2,0,0,0,0,0|1,0,1]=4 180 B6R0.3 C\C=C(/C)C(=O)O HR127692 [2,0,0,0,0,0|0,0,2]=4 181 B6R0.3 C\C=C(/C)C(=O)O HR140908 [2,0,0,0,0,0|0,0,2]=4 182 B6R0.3 NC(CO)C(=O)O HR10704 [2,0,0,0,0,0|2,0,0]=4 183 B6R0.3 NC(CO)C(=O)O HR11003 [2,0,0,0,0,0|2,0,0]=4 184 B6R0.3 NC(CO)C(=O)O HR136009 [2,0,0,0,0,0|2,0,0]=4 185 B6R0.3 NC(CS)C(=O)O HR125082 [2,0,0,0,0,0|2,0,0]=4 186 B6R0.3 NC(CS)C(=O)O HR125295 [2,0,0,0,0,0|2,0,0]=4 187 B6R0.3 NC(CS)C(=O)O HR125344 [2,0,0,0,0,0|2,0,0]=4 188 B6R0.3 NC(CS)C(=O)O HR129167 [2,0,0,0,0,0|2,0,0]=4 189 B6R0.3 NC(CS)C(=O)O HR129315 [2,0,0,0,0,0|2,0,0]=4 190 B6R0.3 NC(CS)C(=O)O HR129684 [2,0,0,0,0,0|2,0,0]=4 191 B6R0.3 NC(CS)C(=O)O HR135781 [2,0,0,0,0,0|2,0,0]=4 192 B6R0.3 NC(CS)C(=O)O HR136316 [2,0,0,0,0,0|2,0,0]=4 193 B6R0.3 NC(C[SeH])C(=O)O HR101211 [2,0,0,0,0,0|2,0,0]=4 194 B6R0.3 NCC(N)C(=O)O HR101827 [2,0,0,0,0,0|2,0,0]=4 195 B6R0.3 NCC(N)C(=O)O HR120379 [2,0,0,0,0,0|2,0,0]=4 196 B6R0.3 NCC(N)C(=O)O HR130162 [2,0,0,0,0,0|2,0,0]=4 197 B6R0.3 NCC(N)C(=O)O HR137268 [2,0,0,0,0,0|2,0,0]=4 198 B6R0.3 NCC(O)C(=O)O HR126827 [2,0,0,0,0,0|2,0,0]=4 199 B6R0.3 NCC(O)C(=O)O HR145757 [2,0,0,0,0,0|2,0,0]=4 200 B6R0.3 NCC(O)C(=O)O HR145758 [2,0,0,0,0,0|2,0,0]=4 201 B6R0.3 O=C(O)C(=O)CBr HR129820 [2,0,0,0,0,0|1,0,0]=3 202 B6R0.3 O=C(O)C(Br)CBr HR128067 [2,0,0,0,0,0|2,0,0]=4 203 B6R0.3 O=C(O)C(Br)CO HR121810 [2,0,0,0,0,0|2,0,0]=4 204 B6R0.3 O=C(O)C(Cl)CCl HR102337 [2,0,0,0,0,0|2,0,0]=4 205 B8R0.5 CCOC(C)OC(C)=O HR121743 [1,1,0,0,0,0|2,0,0]=4 206 B8R0.5 COCC(C)OC(C)=O HR138591 [1,1,0,0,0,0|2,0,0]=4 207 B8R0.19 CCC(O)CC(=O)OC HR111480 [1,1,0,0,0,0|1,0,1]=4 208 B8R0.19 CN\C(C)=C\C(=O)OC HR106272 [1,1,0,0,0,0|1,0,1]=4 209 B8R0.19 COC(=O)NC(C)CN ENSA06712 [1,1,0,0,0,0|2,0,0]=4 210 B8R0.23 CC(C)C(N)CC(=O)O HR115576 [1,1,0,0,0,0|1,0,1]=4 211 B8R0.23 CC(C)C(N)CC(=O)O HR119755 [1,1,0,0,0,0|1,0,1]=4 212 B8R0.23 CC(O)C(N)CC(=O)O HR146732 [1,1,0,0,0,0|1,0,1]=4 213 B8R0.3 C=C(CO)C(=O)OCC HR110396 [1,1,0,0,0,0|2,0,0]=4 214 B8R0.3 CCCC(Br)C(=O)OC HR135374 [1,1,0,0,0,0|1,0,1]=4 215 B8R0.3 CCCC(N)C(=O)OC HR141930 [1,1,0,0,0,0|1,0,1]=4 216 B8R0.3 CCOC(=O)C(=O)CBr NSJB02101 [1,1,0,0,0,0|2,0,0]=4 217 B8R0.3 CCOC(=O)C(=O)CC HR105760 [1,1,0,0,0,0|2,0,0]=4 218 B8R0.3 CCOC(=O)\C(Cl)=N/O HR130373 [1,1,0,0,0,0|2,0,0]=4 219 B8R0.8 C=C(C)C(=O)OCCC HR115069 [1,1,0,0,0,0|2,0,0]=4 220 B8R0.8 CCCCC(=O)C(C)=O HR133012 [1,1,0,0,0,0|1,0,0]=3 221 B8R0.8 CCCCC(Br)C(=O)O HR127260 [1,1,0,0,0,0|1,0,1]=4 222 B8R0.8 CCCCC(C)C(=O)O HR121647 [1,1,0,0,0,0|1,0,1]=4 223 B8R0.8 CCCCC(N)C(=O)O HR133839 [1,1,0,0,0,0|1,0,1]=4 224 B8R0.8 CCCCC(N)C(=O)O HR134634 [1,1,0,0,0,0|1,0,1]=4 225 B8R0.8 CCCCC(N)C(=O)O HR134894 [1,1,0,0,0,0|1,0,1]=4 226 B8R0.8 CCCOC(=O)C(C)O HR104314 [1,1,0,0,0,0|1,0,1]=4 227 B8R0.8 CCCOC(=O)C(C)O HR143626 [1,1,0,0,0,0|1,0,1]=4 228 B8R0.8 CSCCC(N)C(=O)O HR100026 [1,1,0,0,0,0|1,0,1]=4 229 B8R0.8 CSCCC(N)C(=O)O HR123144 [1,1,0,0,0,0|1,0,1]=4 230 B8R0.8 CSCCC(N)C(=O)O HR123406 [1,1,0,0,0,0|1,0,1]=4 231 B8R0.8 CSCCC(N)C(=O)O HR132929 [1,1,0,0,0,0|1,0,1]=4 232 B8R0.8 CSCCC(N)C(=O)O HR137287 [1,1,0,0,0,0|1,0,1]=4 233 B8R0.8 CSCCC(N)[13C](=O)O HR140512 [1,1,0,0,0,0|1,0,1]=4 234 B8R0.8 CSCCC(O)C(=O)O HR136742 [1,1,0,0,0,0|0,0,2]=4 235 B8R0.8 C[35S]CCC(N)C(=O)O HR143199 [1,1,0,0,0,0|1,0,1]=4 236 B8R0.8 C[Se]CCC(N)C(=O)O HR129810 [1,1,0,0,0,0|1,0,1]=4 237 B8R0.8 NC(CCCO)C(=O)O HR114281 [1,1,0,0,0,0|1,0,1]=4 238 B8R0.8 NCCCC(N)C(=O)O HR123396 [1,1,0,0,0,0|1,0,1]=4 239 B8R0.8 NCCCC(N)C(=O)O HR123926 [1,1,0,0,0,0|1,0,1]=4 240 B8R0.8 NCCCC(N)C(=O)O HR124308 [1,1,0,0,0,0|1,0,1]=4 241 B8R0.8 NCCCC(N)C(=O)O HR135672 [1,1,0,0,0,0|1,0,1]=4 242 B8R0.8 NCCCC(N)C(=O)O HR142321 [1,1,0,0,0,0|1,0,1]=4 243 B8R0.8 NCCCC(N)C(=O)O HR143440 [1,1,0,0,0,0|1,0,1]=4 244 B8R0.8 NCCCC(N)C(=O)O ORJL01301 [1,1,0,0,0,0|1,0,1]=4 245 B8R0.12 CCCC(C)(C)C(=O)O HR112968 [1,1,0,0,0,0|1,0,1]=4 246 B8R0.20 C=CC(=O)N(CC)CC HR110467 [1,1,0,0,0,0|2,0,0]=4 247 B8R0.18 CC(C)C(CN)C(=O)O HR100533 [1,1,0,0,0,0|1,0,1]=4 248 B8R0.18 CNC(C(=O)O)C(C)C HR116560 [1,1,0,0,0,0|1,0,1]=4 249 B8R0.27 CC(C)(C)C(=O)C(=O)O HR138192 [1,1,0,0,0,0|0,0,0]=2 250 B8R0.27 CC(C)(C)C(N)C(=O)O HR122176 [1,1,0,0,0,0|1,0,1]=4 251 B8R0.27 CC(C)(C)C(N)C(=O)O HR122428 [1,1,0,0,0,0|1,0,1]=4 252 B8R0.27 CC(C)(C)C(N)C(=O)O HR128603 [1,1,0,0,0,0|1,0,1]=4 253 B8R0.27 CC(C)(C)C(N)C(=O)O HR142898 [1,1,0,0,0,0|1,0,1]=4 254 B8R0.27 CC(C)(F)C(N)C(=O)O HR145132 [1,1,0,0,0,0|1,0,1]=4 255 B8R0.27 CC(C)(O)C(N)C(=O)O HR118044 [1,1,0,0,0,0|1,0,1]=4 256 B8R0.27 CC(C)(S)C(N)C(=O)O HR128482 [1,1,0,0,0,0|1,0,1]=4 257 B8R0.27 O=C(O)C(=O)C(F)(F)F HR104853 [1,1,0,0,0,0|2,0,0]=4 258 B8R0.37 CC(C)C(C)(N)C(=O)O HR100972 [1,1,0,0,0,0|1,0,1]=4 259 B8R0.37 CC(C)C(C)(N)C(=O)O HR142699 [1,1,0,0,0,0|1,0,1]=4 260 B8R0.37 CC(C)C(C)(N)C(=O)O HR142798 [1,1,0,0,0,0|1,0,1]=4 261 B8R0.37 [2H]C(N)(C(=O)O)C(C)C HR139038 [1,1,0,0,0,0|1,0,1]=4 262 B10R0.13 CC(C)C(Br)C(=O)NC(N)=O HR130971 [0,1,0,0,0,1|2,0,0]=4 263 B10R0.13 CC(C)C(Br)C(=O)NC(N)=O HR139648 [0,1,0,0,0,1|2,0,0]=4 264 B10R0.144 CCN(CC)C(=O)CC(C)=O HR140724 [0,1,0,0,0,1|2,0,0]=4 265 B10R0.35 CCOC(=O)C(N)C(C)CC HR125416 [0,2,0,0,0,0|1,0,1]=4 266 B8R1.1 CCC1CCC(=O)O1 HR137195 [1,0,0,1,0,0|2,0,0]=4 267 B8R1.1 O=C1NC(CI)CO1 HR146345 [1,0,0,1,0,0|2,0,0]=4 268 B8R1.1 O=C1OCC(CO)O1 HR107356 [1,0,0,1,0,0|2,0,0]=4 269 B8R1.4 CC1=CC(=O)CCC1 HR142178 [1,0,0,1,0,0|1,0,1]=4 270 B8R1.4 CC1CCCC(=O)C1 HR143817 [1,0,0,1,0,0|1,0,1]=4 271 B8R1.18 CC1=CC(=O)OC1O HR135109 [1,0,0,1,0,0|1,0,1]=4 272 B8R1.34 O=C(O)CC1CCC1 HR133624 [1,0,0,1,0,0|0,0,1]=3 273 B8R1.34 O=C(O)CC1COC1 HR145748 [1,0,0,1,0,0|1,0,1]=4 274 B8R1.5 O=C1CCCCC1=O HR133849 [1,0,0,1,0,0|1,0,0]=3 275 B8R1.7 O=C(O)C1CCCC1 HR124454 [1,0,0,1,0,0|1,0,1]=4 276 B8R1.7 O=C(O)C1CCCN1 HR122958 [1,0,0,1,0,0|1,0,1]=4 277 B8R1.7 O=C(O)C1CCCN1 HR136921 [1,0,0,1,0,0|1,0,1]=4 278 B8R1.7 O=C(O)C1CCCN1 HR142963 [1,0,0,1,0,0|1,0,1]=4 279 B8R1.7 O=C(O)C1CCCN1 SASA03107 [1,0,0,1,0,0|1,0,1]=4 280 B8R1.7 O=C(O)C1CCCO1 HR129714 [1,0,0,1,0,0|0,0,2]=4 281 B8R1.7 O=C(O)C1CCCO1 HR135878 [1,0,0,1,0,0|0,0,2]=4 282 B8R1.7 O=C(O)C1CCCO1 HR136153 [1,0,0,1,0,0|0,0,2]=4 283 B8R1.23 CC1CC(C(=O)O)C1 HR111453 [1,0,0,1,0,0|1,0,1]=4 284 B8R1.54 NC(C(=O)O)C1CC1 HR125656 [1,0,0,1,0,0|1,0,1]=4 285 B8R1.54 NC(C(=O)O)C1CC1 HR126714 [1,0,0,1,0,0|1,0,1]=4 286 B8R1.78 CC1(C(=O)O)CCC1 HR114206 [1,0,0,1,0,0|1,0,1]=4 287 B8R1.78 NC1(C(=O)O)CCC1 HR117609 [1,0,0,1,0,0|1,0,1]=4 288 B8R1.78 NC1(C(=O)O)CCC1 HR127410 [1,0,0,1,0,0|1,0,1]=4 289 B8R1.38 COC(=O)C1CCC1 HR141345 [1,0,0,1,0,0|2,0,0]=4 290 B8R1.39 COC(=O)C1(C)CC1 HR111831 [1,0,0,1,0,0|2,0,0]=4 291 B8R1.50 CC1=C(O)C(=O)CC1 HR129501 [1,0,0,1,0,0|0,0,2]=4 292 B8R1.50 CC1CCC(=O)C1=O HR129446 [1,0,0,1,0,0|0,0,0]=2 293 B8R1.50 CC1CCC(=O)N1C HR142184 [1,0,0,1,0,0|2,0,0]=4 294 B8R1.77 CC1(C)CC1C(=O)O HR125256 [1,0,0,1,0,0|1,0,1]=4 295 B8R1.77 CC1(C)CC1C(=O)O HR138282 [1,0,0,1,0,0|1,0,1]=4 296 B10R1.25 CCC1CNC(=O)CC1=O HR147910 [0,0,0,1,0,1|1,0,0]=3 297 B10R1.475 CCC1(C)CC(=O)NC1=O HR126512 [0,0,0,1,0,1|1,0,0]=3 298 B10R1.475 CCC1(C)NC(=O)NC1=O HR109092 [0,0,0,1,0,1|1,0,0]=3 299 B10R1.475 CCC1(C)NC(=O)NC1=O HR139098 [0,0,0,1,0,1|1,0,0]=3 300 B10R1.113 CC1CCCC(C(=O)O)N1 HR114833 [0,0,0,1,0,1|1,0,1]=4 301 B10R1.113 CC1CCNC(C(=O)O)C1 HR116329 [0,0,0,1,0,1|1,0,1]=4 302 B10R1.23 NC(C(=O)O)C1CCCC1 HR124579 [0,1,0,1,0,0|1,0,1]=4 303 B10R1.34 CCC1CC(C)=C(O)C1=O HR106492 [0,1,0,1,0,0|1,0,0]=3 304 B10R1.34 CCC1OC(=O)C(O)=C1C HR131142 [0,1,0,1,0,0|0,0,2]=4 305 B10R1.34 CCC1OC(C)=C(O)C1=O HR125145 [0,1,0,1,0,0|2,0,0]=4 306 B10R1.34 CCC1OC(C)=C(O)C1=O HR125409 [0,1,0,1,0,0|2,0,0]=4 307 B10R1.61 CC1CCCNC1C(=O)O HR149731 [0,1,0,1,0,0|1,0,1]=4 308 B10R1.61 CC1OCCNC1C(=O)O HR146208 [0,1,0,1,0,0|1,0,1]=4 309 B10R1.2 CCN1CCNC(=O)C1=O HR123615 [0,1,0,1,0,0|2,0,0]=4 310 B10R1.191 CC1=C(C)C(C)C(C)C1=O HR111987 [0,1,0,1,0,0|2,0,0]=4 311 B10R2.355 O=C(O)C1NCC2CC21 HR111017 [0,0,0,2,0,0|1,0,1]=4 312 B8R0.9 CCC(C)COC(=O)Cl HR143745 [1,0,0,0,0,1|1,0,1]=4 313 B8R0.9 CCC(C)COC(C)=O HR104042 [1,0,0,0,0,1|1,0,1]=4 314 B8R0.9 CCC(C)COC(C)=O HR112686 [1,0,0,0,0,1|1,0,1]=4 315 B10R0.57 CCC(C)C(=O)NCC(=O)O HR104919 [0,0,0,0,0,2|0,0,0]=2