HMDB0060866 RDKit 3D Phenytoin dihydrodiol 35 37 0 0 0 0 0 0 0 0999 V2000 -1.3464 -2.0467 3.4366 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2006 -1.8490 2.2009 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2262 -2.7823 1.1324 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0159 -2.1177 -0.1071 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0849 -2.7046 -1.2175 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7224 -0.6951 0.1992 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6699 -0.3319 -0.0696 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4628 -0.0002 0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8674 0.3807 0.7992 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6054 -0.5401 1.5855 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4213 0.3922 -0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9418 1.6880 -0.8098 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5009 0.0150 -1.6592 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 -0.3102 -1.4092 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6947 0.2125 -0.4954 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2821 1.3482 -1.1567 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2146 2.1689 -1.7922 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5489 1.8639 -1.7712 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 0.7204 -1.1037 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0254 -0.1052 -0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 -0.5922 1.6185 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3853 -3.8159 1.3118 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 -0.0086 1.9376 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9728 1.3837 1.3201 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9966 -0.1185 2.3702 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3439 -0.2668 -0.6007 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8682 1.7686 -0.5071 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8816 0.0110 -2.6979 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5952 -0.5847 -2.2291 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 1.6243 -1.1984 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9102 3.0696 -2.3196 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3182 2.4547 -2.2412 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9790 0.4255 -1.0497 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3266 -1.0009 0.0587 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9725 0.3433 2.1173 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 11 13 1 0 13 14 2 0 6 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 6 21 1 0 21 2 1 0 14 7 1 0 20 15 1 0 3 22 1 0 8 23 1 0 9 24 1 0 10 25 1 0 11 26 1 0 12 27 1 0 13 28 1 0 14 29 1 0 16 30 1 0 17 31 1 0 18 32 1 0 19 33 1 0 20 34 1 0 21 35 1 0 M END