HMDB0041923 RDKit 3D Mephedrone 28 28 0 0 0 0 0 0 0 0999 V2000 -4.2454 0.4400 0.7189 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2520 -0.6113 0.8377 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9425 -0.0094 0.5311 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0299 0.4630 -0.9072 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8555 -0.9657 0.7297 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1185 -2.1313 1.1128 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5335 -0.6067 0.4957 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5564 -1.5345 0.6912 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8850 -1.2313 0.4809 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2448 0.0299 0.0611 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6574 0.4235 -0.1844 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2402 0.9506 -0.1339 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9064 0.6600 0.0729 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0838 0.0939 0.0488 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8278 1.3349 0.1842 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6227 0.7897 1.6973 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4417 -1.3865 0.1621 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8854 0.8829 1.1971 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2186 0.0911 -1.5448 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9826 0.1391 -1.4074 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0681 1.5891 -0.9686 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2953 -2.5292 1.0205 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6363 -1.9887 0.6481 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7801 0.8053 -1.2388 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8628 1.3110 0.4599 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3462 -0.4084 0.0234 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 1.9703 -0.4682 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1581 1.4287 -0.0974 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 3 5 1 0 5 6 2 0 5 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 10 12 1 0 12 13 2 0 13 7 1 0 1 14 1 0 1 15 1 0 1 16 1 0 2 17 1 0 3 18 1 0 4 19 1 0 4 20 1 0 4 21 1 0 8 22 1 0 9 23 1 0 11 24 1 0 11 25 1 0 11 26 1 0 12 27 1 0 13 28 1 0 M END