HMDB0256808 RDKit 3D Propacetamol 39 39 0 0 0 0 0 0 0 0999 V2000 -3.9936 -1.0082 -1.9793 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6056 0.3570 -1.4834 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5557 0.4701 -0.0476 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8641 0.3847 0.5613 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6315 1.6479 0.1444 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6226 -0.4636 0.5435 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2144 -0.1718 0.2378 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8987 0.8870 -0.3484 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2241 -1.0617 0.5912 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0949 -0.8007 0.3104 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9329 -0.3832 1.3097 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2882 -0.1029 1.0758 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8309 -0.2375 -0.1733 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1926 -0.0004 -0.4919 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2277 0.2590 0.4081 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6185 0.4836 -0.0909 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0705 0.3173 1.6438 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9707 -0.6650 -1.1973 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6471 -0.9332 -0.9441 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8569 -0.9666 -3.1005 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2696 -1.7968 -1.6443 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0100 -1.2740 -1.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6844 0.7272 -1.9405 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4292 1.0507 -1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3870 -0.4866 0.1219 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8172 0.3114 1.6604 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2981 1.9659 0.9567 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9375 2.4890 -0.0806 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2068 1.4535 -0.8098 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9019 -1.5280 0.3513 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7359 -0.3320 1.6615 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5967 -0.2499 2.3313 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9073 0.2323 1.9082 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4601 -0.0170 -1.5213 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0197 1.4603 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2082 -0.3821 0.3417 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6451 0.3968 -1.2018 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4022 -0.7694 -2.1873 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0316 -1.2626 -1.7898 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 4 5 1 0 3 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 1 0 15 17 2 0 13 18 1 0 18 19 2 0 19 10 1 0 1 20 1 0 1 21 1 0 1 22 1 0 2 23 1 0 2 24 1 0 4 25 1 0 4 26 1 0 5 27 1 0 5 28 1 0 5 29 1 0 6 30 1 0 6 31 1 0 11 32 1 0 12 33 1 0 14 34 1 0 16 35 1 0 16 36 1 0 16 37 1 0 18 38 1 0 19 39 1 0 M END