0 B7R0.4 CC(C)CCCCBr B43898 [0,0,0,0,0,0|2,0,1]=3 1 B7R0.4 CC(C)CCN=[N+]=[N-] A3458 [0,0,0,0,0,0|3,0,0]=3 2 B7R0.4 CCCCC[C@H](C)O H43947 [0,0,0,0,0,0|3,0,1]=4 3 B7R0.4 CN(C)CCCCO D41621 [0,0,0,0,0,0|2,0,2]=4 4 B7R0.4 CN(C)CCN=[N+]=[N-] A5179 [0,0,0,0,0,0|4,0,0]=4 5 B6R0.4 CC(C)CCCO M67872 [1,0,0,0,0,0|0,0,2]=3 6 B6R0.4 CC(C)NCCCl C40431 [1,0,0,0,0,0|2,0,1]=4 7 B6R0.4 CC(C)OCCBr B69154 [1,0,0,0,0,0|2,0,1]=4 8 B6R0.4 CN(C)CCCBr B40430 [1,0,0,0,0,0|2,0,1]=4 9 B6R0.4 CN(C)CCCCl C69241 [1,0,0,0,0,0|2,0,1]=4 10 B6R0.4 CN(C)\C=C\C=O D36904 [1,0,0,0,0,0|1,0,2]=4 11 B6R0.4 CNCCN(C)C T41392 [1,0,0,0,0,0|2,0,1]=4 12 B6R0.6 C=CCCCCBr B9212 [1,0,0,0,0,0|3,0,0]=4 13 B6R0.6 C=CCCCCO H41549 [1,0,0,0,0,0|3,0,0]=4 14 B6R0.6 C=CCCCC[Mg+] H5025 [1,0,0,0,0,0|3,0,0]=4 15 B6R0.6 C=COCCON V65141 [1,0,0,0,0,0|3,0,0]=4 16 B6R0.6 CC=CCCCO H41548 [1,0,0,0,0,0|3,0,0]=4 17 B6R0.6 CCCCCC[Mg+] H31703 [1,0,0,0,0,0|2,0,1]=4 18 B6R0.6 CCCCCNC M41618 [1,0,0,0,0,0|3,0,0]=4 19 B6R0.6 CCCCN=[N+]=[N-] A1814 [1,0,0,0,0,0|3,0,0]=4 20 B6R0.6 O=CCCCCCl C41277 [1,0,0,0,0,0|2,0,0]=3 21 B6R0.6 O=CCCCCO H32202 [1,0,0,0,0,0|2,0,0]=3 22 B8R0.7 CC(C)NCCCCO I38536 [0,1,0,0,0,0|1,0,2]=4 23 B8R0.7 CN(C)CCOCCO D68347 [0,1,0,0,0,0|1,0,2]=4 24 B8R0.9 CC(C)O\C=C(/Br)C=O B1138 [0,1,0,0,0,0|2,0,1]=4 25 B8R0.21 CC(C)(S)CCOC=O M41553 [0,1,0,0,0,0|0,0,0]=1 26 B8R0.21 C[Si](C)(C)CCOCCl C25285 [0,1,0,0,0,0|1,1,1]=4 27 B8R0.28 CC(=O)CCC=C(C)C M68353 [0,1,0,0,0,0|1,0,2]=4 28 B8R0.28 CC(=O)CCCC(=O)O A41468 [0,1,0,0,0,0|2,0,1]=4 29 B8R0.28 CC(=O)OCOC(C)=O M41231 [0,1,0,0,0,0|2,0,1]=4 30 B8R0.28 CN(C)CCCC(=O)O D43497 [0,1,0,0,0,0|2,0,0]=3 31 B8R0.28 CN(C)C\C=C\C(=O)O D25643 [0,1,0,0,0,0|2,0,1]=4 32 B8R1.4 CC1CC(N)CCO1 M26284 [0,0,0,1,0,0|2,0,1]=4 33 B8R1.4 CC1CC(O)CCO1 M14345 [0,0,0,1,0,0|2,0,1]=4 34 B8R1.4 CN1CCCC(=O)C1 M13651 [0,0,0,1,0,0|2,0,0]=3 35 B8R1.4 CN1CCNC(=O)C1 M6975 [0,0,0,1,0,0|2,0,0]=3 36 B8R1.4 CN1CCOC(=O)C1 M41260 [0,0,0,1,0,0|1,0,0]=2 37 B8R1.4 C[C@@H]1CC(=O)CCN1 M10735 [0,0,0,1,0,0|2,0,0]=3 38 B8R1.4 C[C@@H]1CC(=O)CCO1 M11329 [0,0,0,1,0,0|2,0,0]=3 39 B8R1.4 C[C@@H]1CNCC(=O)N1 M13313 [0,0,0,1,0,0|3,0,0]=4 40 B8R1.4 C[C@@H]1COCC(=O)N1 M17373 [0,0,0,1,0,0|3,0,0]=4 41 B8R1.4 C[C@H]1CC(=O)CCN1 M10734 [0,0,0,1,0,0|2,0,0]=3 42 B8R1.4 C[C@H]1CC(=O)CCN1 M19737 [0,0,0,1,0,0|2,0,0]=3 43 B8R1.4 C[C@H]1CC(=O)CCN1 M8156 [0,0,0,1,0,0|2,0,0]=3 44 B8R1.4 C[C@H]1CC(=O)CCO1 M11328 [0,0,0,1,0,0|2,0,0]=3 45 B8R1.4 C[C@H]1CC(=O)CCO1 M14197 [0,0,0,1,0,0|2,0,0]=3 46 B8R1.4 C[C@H]1CCCC(=O)N1 M23832 [0,0,0,1,0,0|2,0,0]=3 47 B8R1.4 C[C@H]1CCNC(=O)C1 M23793 [0,0,0,1,0,0|1,0,0]=2 48 B8R1.4 C[C@H]1CNCC(=O)N1 M11164 [0,0,0,1,0,0|3,0,0]=4 49 B8R1.4 N[C@H]1CCNC(=O)C1 A0054 [0,0,0,1,0,0|2,0,0]=3 50 B8R1.4 N[C@H]1CCNC(=O)C1 A37105 [0,0,0,1,0,0|2,0,0]=3 51 B8R1.4 O=C1CCCC(=O)C1 C38740 [0,0,0,1,0,0|2,0,1]=4 52 B8R1.4 O=C1CCNC(=O)C1 P7969 [0,0,0,1,0,0|2,0,1]=4 53 B8R1.4 O=C1C[C@@H](O)CCN1 H38902 [0,0,0,1,0,0|2,0,0]=3 54 B8R1.4 O=C1C[C@@H](O)CCN1 H41262 [0,0,0,1,0,0|2,0,0]=3 55 B8R1.6 CCOC1CC(N)C1 E15188 [0,0,0,1,0,0|2,0,1]=4 56 B8R1.6 CCO[C@H]1C[C@@H](N)C1 E19476 [0,0,0,1,0,0|2,0,1]=4 57 B8R1.6 CCO[C@H]1C[C@H](N)C1 E15190 [0,0,0,1,0,0|2,0,1]=4 58 B8R1.7 CC(C)[C@@H]1CCCN1 P29867 [0,0,0,1,0,0|2,0,1]=4 59 B8R1.7 CC(C)[C@H]1CCCN1 P29967 [0,0,0,1,0,0|2,0,1]=4 60 B8R1.19 CC1(C)CCNC1=O D13691 [0,0,0,1,0,0|1,0,0]=2 61 B8R1.19 O=C1NCCC1(F)F D29703 [0,0,0,1,0,0|3,0,0]=4 62 B8R1.72 CC1(C)CCNCC1 D0628 [0,0,0,1,0,0|2,0,1]=4 63 B8R1.72 CC1(N)CCOCC1 M10391 [0,0,0,1,0,0|2,0,1]=4 64 B8R1.72 CC1(O)CCOCC1 M25219 [0,0,0,1,0,0|2,0,1]=4 65 B5R0.1 C=CC[C@H](C)O P62507 [2,0,0,0,0,0|1,0,1]=4 66 B5R0.1 CC(C)CNN B40316 [2,0,0,0,0,0|2,0,0]=4 67 B5R0.1 CC(C)\C=N\O I2624 [2,0,0,0,0,0|1,0,1]=4 68 B5R0.1 CCC[C@@H](C)N P16023 [2,0,0,0,0,0|1,0,1]=4 69 B5R0.1 CCC[C@H](C)N P22363 [2,0,0,0,0,0|1,0,1]=4 70 B5R0.1 CN(C)CC=O D39943 [2,0,0,0,0,0|1,0,0]=3 71 B5R0.1 CN(C)CCBr B39953 [2,0,0,0,0,0|2,0,0]=4 72 B5R0.1 CN(C)NC=O D66358 [2,0,0,0,0,0|2,0,0]=4 73 B5R0.1 COC[C@@H](C)N M40311 [2,0,0,0,0,0|1,0,1]=4 74 B5R0.1 COC[C@@H](C)O M39959 [2,0,0,0,0,0|1,0,1]=4 75 B5R0.1 COC[C@H](C)O M61064 [2,0,0,0,0,0|1,0,1]=4 76 B5R0.1 C[C@@H](N)CCO A10772 [2,0,0,0,0,0|1,0,0]=3 77 B5R0.1 C[C@H](N)CCO A10771 [2,0,0,0,0,0|1,0,0]=3 78 B5R0.1 C[C@H](N)CCO A39964 [2,0,0,0,0,0|1,0,0]=3 79 B5R0.1 C[C@H](O)CCO B68917 [2,0,0,0,0,0|1,0,0]=3 80 B5R0.1 OCCC(F)F D60407 [2,0,0,0,0,0|2,0,0]=4 81 B5R0.2 C=CCCCBr B41237 [2,0,0,0,0,0|2,0,0]=4 82 B5R0.2 C=CCCCCl C41238 [2,0,0,0,0,0|2,0,0]=4 83 B5R0.2 C=CCCCO P36921 [2,0,0,0,0,0|2,0,0]=4 84 B5R0.2 CCCCON B40310 [2,0,0,0,0,0|1,0,0]=3 85 B5R0.2 CNCCOC M23409 [2,0,0,0,0,0|1,0,1]=4 86 B5R0.2 COCCCBr B68335 [2,0,0,0,0,0|1,0,1]=4 87 B5R0.2 COCCCO M69411 [2,0,0,0,0,0|1,0,1]=4 88 B7R0.2 CC(C)C[C@@H](N)CO L41620 [1,1,0,0,0,0|0,0,2]=4 89 B7R0.2 CC(C)C[C@H](N)CO A68907 [1,1,0,0,0,0|0,0,2]=4 90 B7R0.6 CC(=O)CCC(C)=O H64912 [1,1,0,0,0,0|1,0,1]=4 91 B7R0.6 CC(=O)NNC(C)C P40426 [1,1,0,0,0,0|2,0,0]=4 92 B7R0.6 CN(C)CCC(=O)O D41335 [1,1,0,0,0,0|1,0,0]=3 93 B7R0.6 O=C(O)CCC(F)F D59737 [1,1,0,0,0,0|2,0,0]=4 94 B7R0.1 C=CCCCCCBr B43831 [1,1,0,0,0,0|2,0,0]=4 95 B7R0.1 C=CCCCCNC M43901 [1,1,0,0,0,0|2,0,0]=4 96 B7R0.1 C=CCCCCNC M46504 [1,1,0,0,0,0|2,0,0]=4 97 B7R0.1 O=CCCCCC=O A3137 [1,1,0,0,0,0|1,0,1]=4 98 B9R0.53 CC(C)C[C@H](N)CC(=O)O A43926 [0,2,0,0,0,0|1,0,0]=3 99 B9R0.53 CC(C)C[C@H](N)CC(=O)O A43928 [0,2,0,0,0,0|1,0,0]=3 100 B9R0.55 CC(=O)CCCOC(C)=O X62778 [0,2,0,0,0,0|1,0,1]=4 101 B9R0.7 CC(C)CC[C@@H](N)C(=O)O A43927 [0,2,0,0,0,0|1,0,0]=3 102 B9R0.56 CC(=O)SCC[N+](C)(C)C A38049 [0,2,0,0,0,0|1,1,0]=4 103 B7R1.2 CC1=CC(=O)CC1 M22783 [1,0,0,1,0,0|0,0,2]=4 104 B7R1.2 CN1CCC(=O)C1 M5444 [1,0,0,1,0,0|1,0,0]=3 105 B7R1.2 C[C@@H]1CNC(=O)C1 P22910 [1,0,0,1,0,0|1,0,0]=3 106 B7R1.2 C[C@@H]1COC(=O)N1 M32194 [1,0,0,1,0,0|1,0,0]=3 107 B7R1.2 C[C@H]1CCC(=O)N1 M61805 [1,0,0,1,0,0|1,0,0]=3 108 B7R1.2 C[C@H]1COC(=O)N1 M40226 [1,0,0,1,0,0|1,0,0]=3 109 B7R1.2 N[C@@H]1CNC(=O)C1 A11620 [1,0,0,1,0,0|2,0,0]=4 110 B7R1.2 N[C@@H]1CNC(=O)C1 A20556 [1,0,0,1,0,0|2,0,0]=4 111 B7R1.2 N[C@@H]1CNC(=O)C1 A24834 [1,0,0,1,0,0|2,0,0]=4 112 B7R1.2 N[C@@H]1CNC(=O)C1 P21713 [1,0,0,1,0,0|2,0,0]=4 113 B7R1.2 N[C@@H]1COC(=O)C1 A40337 [1,0,0,1,0,0|1,0,0]=3 114 B7R1.2 N[C@H]1CNC(=O)C1 A27147 [1,0,0,1,0,0|2,0,0]=4 115 B7R1.2 N[C@H]1COC(=O)C1 A37707 [1,0,0,1,0,0|1,0,0]=3 116 B7R1.2 O=C1CCC(=O)C1 C13761 [1,0,0,1,0,0|1,0,1]=4 117 B7R1.2 O=C1CC[C@H](O)C1 H22750 [1,0,0,1,0,0|1,0,0]=3 118 B7R1.2 O=C1C[C@@H](O)CN1 H22487 [1,0,0,1,0,0|2,0,0]=4 119 B7R1.2 O=C1C[C@@H](S)CN1 M12154 [1,0,0,1,0,0|2,0,0]=4 120 B7R1.2 O=C1C[C@H](O)CN1 H15629 [1,0,0,1,0,0|2,0,0]=4 121 B7R1.2 O=C1C[C@H](O)CN1 H38056 [1,0,0,1,0,0|2,0,0]=4 122 B7R1.2 O=C1OC[C@H](F)O1 F39135 [1,0,0,1,0,0|2,0,0]=4 123 B7R1.3 BrC1CCOCC1 B1507 [1,0,0,1,0,0|1,0,1]=4 124 B7R1.3 C[C@@H]1CCCNC1 M43474 [1,0,0,1,0,0|1,0,1]=4 125 B7R1.3 ClC1CCOCC1 C4527 [1,0,0,1,0,0|1,0,1]=4 126 B7R1.3 IC1CCOCC1 I1189 [1,0,0,1,0,0|1,0,1]=4 127 B7R1.3 NC1CCOCC1 A1504 [1,0,0,1,0,0|1,0,1]=4 128 B7R1.3 NC1CCOCC1 T1169 [1,0,0,1,0,0|1,0,1]=4 129 B7R1.3 OC1CCOCC1 H0389 [1,0,0,1,0,0|1,0,1]=4 130 B7R1.3 [Mg+]C1CCOCC1 T8353 [1,0,0,1,0,0|1,0,1]=4 131 B7R1.3 [Mg+]C1CCOCC1 T8354 [1,0,0,1,0,0|1,0,1]=4 132 B7R1.10 COC1CC(N)C1 M0320 [1,0,0,1,0,0|1,0,1]=4 133 B7R1.10 CO[C@H]1C[C@@H](N)C1 SB7404 [1,0,0,1,0,0|1,0,1]=4 134 B7R1.10 CO[C@H]1C[C@H](N)C1 SB7405 [1,0,0,1,0,0|1,0,1]=4 135 B7R1.14 CC1(C)CCCN1 D24602 [1,0,0,1,0,0|1,0,1]=4 136 B7R1.14 CC1(C)CCNC1 D1149 [1,0,0,1,0,0|1,0,1]=4 137 B7R1.14 C[C@]1(N)CCOC1 A11772 [1,0,0,1,0,0|1,0,1]=4 138 B7R1.17 CC1(C)CCC1=O D60316 [1,0,0,1,0,0|0,0,0]=2 139 B7R1.17 CC1(C)CC[C@@H]1O D60329 [1,0,0,1,0,0|0,0,2]=4 140 B7R1.23 CC1(C)C[C@@H]1C#N D43322 [1,0,0,1,0,0|1,0,1]=4 141 B7R1.1 O=CC1=CCCC1 C69466 [1,0,0,1,0,0|1,0,1]=4 142 B7R1.1 O=CC1CCCC1 C25963 [1,0,0,1,0,0|1,0,0]=3 143 B7R1.4 CN1CCNC1=O M40241 [1,0,0,1,0,0|2,0,0]=4 144 B7R1.4 C[C@@H]1OCCC1=O M41223 [1,0,0,1,0,0|2,0,0]=4 145 B7R1.4 C[C@H]1CCCC1=O M41458 [1,0,0,1,0,0|1,0,0]=3 146 B7R1.4 C[C@H]1CCNC1=O M41257 [1,0,0,1,0,0|1,0,0]=3 147 B7R1.4 C[C@H]1CCOC1=O M41224 [1,0,0,1,0,0|0,0,0]=2 148 B7R1.4 N[C@@H]1CCNC1=O A40242 [1,0,0,1,0,0|2,0,0]=4 149 B7R1.4 N[C@@H]1CCNC1=O A62971 [1,0,0,1,0,0|2,0,0]=4 150 B7R1.4 N[C@@H]1CCOC1=O H68344 [1,0,0,1,0,0|1,0,0]=3 151 B7R1.4 N[C@H]1CCNC1=O A24294 [1,0,0,1,0,0|2,0,0]=4 152 B7R1.4 N[C@H]1CCOC1=O A40300 [1,0,0,1,0,0|1,0,0]=3 153 B7R1.4 N[C@H]1CCOC1=O A40335 [1,0,0,1,0,0|1,0,0]=3 154 B7R1.4 O=C1NCC[C@@H]1O H20173 [1,0,0,1,0,0|2,0,0]=4 155 B7R1.4 O=C1NCC[C@@H]1O H37914 [1,0,0,1,0,0|2,0,0]=4 156 B7R1.4 O=C1NCC[C@H]1O H40227 [1,0,0,1,0,0|2,0,0]=4 157 B7R1.4 O=C1OCC[C@@H]1Br B31114 [1,0,0,1,0,0|1,0,0]=3 158 B7R1.8 O=C1CC[C@@H]1CO H13228 [1,0,0,1,0,0|2,0,0]=4 159 B9R1.34 CC1CC(=O)CC(=O)C1 M43717 [0,1,0,1,0,0|1,0,1]=4 160 B9R1.34 C[C@H]1CC(=O)C[C@@H](C)O1 D19918 [0,1,0,1,0,0|2,0,0]=4 161 B9R1.38 CC1(C)CC(=O)OC1=O D67953 [0,1,0,1,0,0|0,0,1]=3 162 B9R1.41 CC(=O)[C@@H]1CCOC1=O A60775 [0,1,0,1,0,0|1,0,1]=4 163 B9R1.48 C[C@H]1CC(=O)NCCN1 H7872 [0,1,0,1,0,0|1,0,0]=3 164 B9R1.53 CC(=O)NC1CC(N)C1 A30123 [0,1,0,1,0,0|2,0,0]=4 165 B9R1.53 CC(=O)NC1CC(N)C1 N14377 [0,1,0,1,0,0|2,0,0]=4 166 B9R1.53 CC(=O)OC1CC(=O)C1 X11663 [0,1,0,1,0,0|1,0,1]=4 167 B9R1.53 NC1CC(CC(=O)O)C1 A11674 [0,1,0,1,0,0|2,0,0]=4 168 B9R1.53 N[C@H]1C[C@@H](CC(=O)O)C1 A11675 [0,1,0,1,0,0|2,0,0]=4 169 B9R1.53 N[C@H]1C[C@@H](CC(=O)O)C1 A14838 [0,1,0,1,0,0|2,0,0]=4 170 B9R1.53 N[C@H]1C[C@H](CC(=O)O)C1 A11676 [0,1,0,1,0,0|2,0,0]=4 171 B9R1.66 CC1(C)CC(=O)CCN1 D46484 [0,1,0,1,0,0|2,0,0]=4 172 B9R1.66 CC1(C)CC(=O)CCO1 D17314 [0,1,0,1,0,0|2,0,0]=4 173 B9R1.66 CC1(C)CCCC(=O)C1 D22905 [0,1,0,1,0,0|1,0,0]=3 174 B9R1.136 O=CNC1CC(F)(F)C1 D67130 [0,1,0,1,0,0|2,0,0]=4 175 B9R1.2 CCN1CCNC(=O)C1 E43465 [0,1,0,1,0,0|2,0,0]=4 176 B9R1.2 N#C[C@H]1CCCC(=O)C1 X46385 [0,1,0,1,0,0|1,0,1]=4 177 B9R1.2 NC[C@H]1CCCC(=O)N1 A37687 [0,1,0,1,0,0|2,0,0]=4 178 B9R1.2 NC[C@H]1CCNC(=O)C1 A7242 [0,1,0,1,0,0|1,0,0]=3 179 B9R1.2 O=C1C[C@@H](CO)CCN1 X0577 [0,1,0,1,0,0|1,0,0]=3 180 B9R1.16 C=CCCC[C@@H]1C[C@H]1O P66476 [0,1,0,1,0,0|2,0,0]=4 181 B9R1.49 CN1CCNC(=O)CC1 M10175 [0,1,0,1,0,0|2,0,0]=4 182 B9R1.49 N[C@H]1CCCC(=O)NC1 A43464 [0,1,0,1,0,0|2,0,0]=4 183 B9R1.49 O=C1CCC[C@H](O)CN1 H41499 [0,1,0,1,0,0|2,0,0]=4 184 B9R1.118 CC1(CN)CCOCC1 A14519 [0,1,0,1,0,0|1,0,1]=4 185 B9R1.118 CC1(CO)CCOCC1 H14518 [0,1,0,1,0,0|1,0,1]=4 186 B9R1.40 CC1(C)CCCOC1=O D63281 [0,1,0,1,0,0|0,0,0]=2 187 B9R1.40 CC1(C)CNCCC1=O D11692 [0,1,0,1,0,0|1,0,0]=3 188 B9R1.40 CC1(C)COCCC1=O D24609 [0,1,0,1,0,0|1,0,0]=3 189 B9R1.40 CC1(C)NCCNC1=O D10774 [0,1,0,1,0,0|1,0,0]=3 190 B9R1.35 CC(=O)N1CC[C@@H](O)C1 A7835 [0,1,0,1,0,0|2,0,0]=4 191 B9R1.35 CC(=O)N1CC[C@H](N)C1 A14633 [0,1,0,1,0,0|2,0,0]=4 192 B9R1.35 CC(=O)N1CC[C@H](O)C1 H41507 [0,1,0,1,0,0|2,0,0]=4 193 B9R1.35 CC(C)[C@@H]1COC(=O)N1 P26884 [0,1,0,1,0,0|0,0,0]=2 194 B9R1.35 CC(C)[C@@H]1CSC(=S)N1 P41522 [0,1,0,1,0,0|0,2,0]=4 195 B9R1.35 CC(C)[C@H]1COC(=O)N1 P41504 [0,1,0,1,0,0|0,0,0]=2 196 B9R1.35 CN1CC[C@@H](C(=O)O)C1 M14179 [0,1,0,1,0,0|2,0,0]=4 197 B9R1.35 CN1CC[C@@H](C(=O)O)C1 M27617 [0,1,0,1,0,0|2,0,0]=4 198 B9R1.35 CN1CC[C@H](C(=O)O)C1 M11319 [0,1,0,1,0,0|2,0,0]=4 199 B9R1.35 CN1CC[C@H](C(=O)O)C1 M23984 [0,1,0,1,0,0|2,0,0]=4 200 B9R1.35 CN1CC[C@H](C(=O)O)C1 M7624 [0,1,0,1,0,0|2,0,0]=4 201 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)N1 M60259 [0,1,0,1,0,0|2,0,0]=4 202 B9R1.35 C[C@H]1CC[C@H](C(=O)O)N1 M60278 [0,1,0,1,0,0|2,0,0]=4 203 B9R1.35 NC1CCC(C(=O)O)C1 A11845 [0,1,0,1,0,0|2,0,0]=4 204 B9R1.35 NC1CCC(C(=O)O)C1 A15670 [0,1,0,1,0,0|2,0,0]=4 205 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 A15249 [0,1,0,1,0,0|2,0,0]=4 206 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 A20649 [0,1,0,1,0,0|2,0,0]=4 207 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 A15248 [0,1,0,1,0,0|2,0,0]=4 208 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 A43449 [0,1,0,1,0,0|2,0,0]=4 209 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 A25040 [0,1,0,1,0,0|2,0,0]=4 210 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 A43450 [0,1,0,1,0,0|2,0,0]=4 211 B9R1.35 O=C(O)C1CCC(O)C1 H41473 [0,1,0,1,0,0|2,0,0]=4 212 B9R1.35 O=C1N[C@H](C(F)F)CO1 D59979 [0,1,0,1,0,0|2,0,0]=4 213 B9R1.69 CN1CC[C@H](N)CC1=O A0206 [0,1,0,1,0,0|2,0,0]=4 214 B9R1.69 CN1CC[C@H](N)CC1=O M7462 [0,1,0,1,0,0|2,0,0]=4 215 B9R1.106 CC1(C)C(=O)CCC1=O D43718 [0,1,0,1,0,0|1,0,1]=4 216 B9R1.106 CC1(C)C(=O)NC[C@@H]1N A20133 [0,1,0,1,0,0|1,0,0]=3 217 B9R1.106 CC1(C)C(=O)NC[C@@H]1N A20919 [0,1,0,1,0,0|1,0,0]=3 218 B9R1.106 CC1(C)C(=O)NC[C@H]1N A20868 [0,1,0,1,0,0|1,0,0]=3 219 B9R1.10 CC1(C)C=CC(=O)CC1 D47014 [0,1,0,1,0,0|2,0,0]=4 220 B9R1.166 CC1(C)CN[C@@H]1C(=O)O A30117 [0,1,0,1,0,0|2,0,0]=4 221 B9R2.39 O=C1NC2CCC1C2 A64651 [0,0,0,2,0,0|2,0,0]=4 222 B9R2.39 O=C1OC2CCC1C2 X31814 [0,0,0,2,0,0|2,0,0]=4 223 B9R2.8 O=C1CC2CC(C1)C2 B60206 [0,0,0,2,0,0|1,0,0]=3 224 B9R2.21 O=C1CC2CC2CN1 A59683 [0,0,0,2,0,0|1,0,0]=3 225 B9R2.109 O=C1CCCC2CC12 B13672 [0,0,0,2,0,0|1,0,0]=3 226 B9R2.109 O=C1CCCC2OC12 X43306 [0,0,0,2,0,0|2,0,0]=4