HMDB0015541 RDKit 3D Meticillin 46 48 0 0 0 0 0 0 0 0999 V2000 -5.3154 0.9100 3.0047 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1258 0.8213 2.2575 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0387 -0.1637 1.2727 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1041 -0.9853 1.0857 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0361 -1.9656 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8868 -2.0782 -0.6316 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7885 -1.2354 -0.4427 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6694 -1.4117 -1.2341 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6709 -2.4306 -2.2016 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 -0.2493 0.5198 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7785 0.6778 0.8124 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9713 1.5245 1.7246 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5455 0.7335 0.1776 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4941 1.6932 0.5097 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0725 2.4443 -0.5998 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6367 3.3591 -1.3427 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3122 1.7579 -0.5295 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6282 1.2919 -0.8682 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6228 1.9953 -0.0203 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2524 2.8532 0.8367 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9878 1.7681 -0.1058 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6631 -0.2033 -0.6902 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8366 -0.6614 0.1506 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6542 -0.9453 -1.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1623 -0.5585 0.2913 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8543 1.1936 0.7290 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.2523 1.7151 3.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1961 1.0571 2.3411 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4702 -0.0602 3.5116 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0044 -0.8871 1.6808 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8949 -2.6098 -0.0177 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8523 -2.8602 -1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6152 -3.4498 -1.7763 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5043 -2.3376 -2.9237 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7351 -2.3093 -2.8138 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3261 0.0657 -0.5794 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1688 2.3591 1.3229 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8748 1.5058 -1.9088 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6007 1.9191 0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9663 -0.0015 1.0332 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5792 -1.6676 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7832 -0.6687 -0.4238 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5398 -0.6508 -2.5614 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7419 -0.7604 -2.5746 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7773 -2.0303 -1.7485 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4066 1.5360 1.6214 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 7 10 2 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 18 22 1 0 22 23 1 0 22 24 1 0 22 25 1 0 25 26 1 0 10 3 1 0 26 14 1 0 26 17 1 0 1 27 1 0 1 28 1 0 1 29 1 0 4 30 1 0 5 31 1 0 6 32 1 0 9 33 1 0 9 34 1 0 9 35 1 0 13 36 1 0 14 37 1 1 18 38 1 6 21 39 1 0 23 40 1 0 23 41 1 0 23 42 1 0 24 43 1 0 24 44 1 0 24 45 1 0 26 46 1 1 M END