HMDB0035598 RDKit 3D Aflatoxin B2a 38 42 0 0 0 0 0 0 0 0999 V2000 -2.0540 3.5952 0.1661 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1787 2.1892 0.0961 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0614 1.4282 -0.0803 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1935 2.0411 -0.1906 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 1.2784 -0.3711 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2434 -0.0963 -0.4428 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0141 -0.6925 -0.3344 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0663 -1.9941 -0.4039 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2197 -2.6032 -0.3055 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2475 -3.8642 -0.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4002 -1.9049 -0.1245 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3847 -0.5259 -0.0428 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1162 0.0607 -0.1561 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7368 -0.0702 0.1375 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4486 -1.2466 0.7713 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8032 -2.3683 0.0177 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2779 -3.4448 -0.4083 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6111 -0.5789 -0.6339 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2893 -0.9956 0.6596 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7398 -0.6696 0.2826 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5461 -0.6381 1.4172 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6484 0.5335 -0.3678 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4467 0.6325 -1.0092 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6583 1.6897 -0.5008 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3576 3.8942 0.9957 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6112 3.9094 -0.8244 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0333 4.1027 0.2374 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2194 3.1222 -0.1285 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2045 0.0290 -0.8891 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9502 0.8706 0.6378 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1711 -1.3458 1.8552 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5383 -1.2164 0.6261 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7078 -1.3770 -1.3887 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9490 -0.3172 1.4402 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1587 -2.0621 0.8742 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0903 -1.4749 -0.3907 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4844 -0.6581 1.0946 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5212 0.7682 -2.0995 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 2 0 12 13 1 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 6 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 23 24 1 0 13 3 1 0 23 18 1 0 24 5 1 0 13 7 2 0 16 11 1 0 1 25 1 0 1 26 1 0 1 27 1 0 4 28 1 0 14 29 1 0 14 30 1 0 15 31 1 0 15 32 1 0 18 33 1 0 19 34 1 0 19 35 1 0 20 36 1 0 21 37 1 0 23 38 1 0 M END