HMDB0014397 RDKit 3D Phenytoin 31 33 0 0 0 0 0 0 0 0999 V2000 0.7358 -3.9295 -1.1683 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2583 -2.9755 -0.4868 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2594 -2.8409 0.9284 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3903 -1.6071 1.1972 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9418 -1.2768 2.2958 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2838 -0.8141 -0.0567 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0675 -0.1767 -0.0261 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7445 0.0818 1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9867 0.6720 1.1785 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5755 1.0176 -0.0096 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9187 0.7698 -1.2023 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6613 0.1713 -1.2153 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3473 0.2261 -0.0995 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1859 0.3180 -1.1822 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1609 1.3155 -1.1638 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2571 2.1637 -0.0865 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4021 2.0450 0.9814 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 1.0682 0.9823 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3937 -1.8175 -1.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6589 -3.5147 1.6404 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3002 -0.1827 2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5063 0.8678 2.1284 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5703 1.4916 -0.0048 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3929 1.0466 -2.1281 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2157 0.0129 -2.1877 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1211 -0.3419 -2.0364 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8211 1.3745 -2.0349 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0287 2.9360 -0.0967 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5144 2.7417 1.8173 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7666 1.0004 1.8474 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8029 -1.8430 -1.9864 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 2 0 10 11 1 0 11 12 2 0 6 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 6 19 1 0 19 2 1 0 12 7 1 0 18 13 1 0 3 20 1 0 8 21 1 0 9 22 1 0 10 23 1 0 11 24 1 0 12 25 1 0 14 26 1 0 15 27 1 0 16 28 1 0 17 29 1 0 18 30 1 0 19 31 1 0 M END