HMDB0250500 RDKit 3D (2S,3S)-1-[[2-Methoxy-5-(trifluoromethoxy)phenyl]methyl]-2-phenylpiperidin-3-... 50 52 0 0 0 0 0 0 0 0999 V2000 2.2949 3.3621 2.6348 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6094 2.2980 2.0678 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2565 1.3379 1.2883 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6138 1.4741 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2979 0.5532 0.3309 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6455 -0.5148 -0.2459 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3386 -1.4385 -1.0109 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4531 -1.1926 -2.4056 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1161 0.0240 -2.5608 F 0 0 0 0 0 0 0 0 0 0 0 0 5.2446 -2.1426 -3.0209 F 0 0 0 0 0 0 0 0 0 0 0 0 3.2437 -1.0763 -3.0284 F 0 0 0 0 0 0 0 0 0 0 0 0 2.2723 -0.6332 -0.0347 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5864 0.2787 0.7214 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1333 0.1914 0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5443 -0.9122 0.3917 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2242 -2.2092 0.8791 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5586 -3.1833 -0.2328 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0512 -3.1538 -0.4241 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7073 -1.8397 -0.3149 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0603 -1.3242 -1.6477 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9632 -0.7573 0.4123 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4356 0.5378 -0.0907 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4142 1.2333 0.5877 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8918 2.4556 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3698 3.0001 -0.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3889 2.3466 -1.7167 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9439 1.1295 -1.2458 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0027 3.0491 3.4259 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8802 3.8743 1.8248 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5556 4.1189 2.9885 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1776 2.3086 1.5311 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3834 0.6676 0.1778 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8124 -1.4840 -0.5195 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2775 1.1688 0.6075 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0598 0.2009 2.0601 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7328 -2.3589 1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9967 -2.4382 1.6864 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0085 -2.9084 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2671 -4.2033 0.0805 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2392 -3.5635 -1.4604 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 -3.9208 0.2553 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6907 -1.9737 0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6606 -2.0967 -2.0668 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7506 -0.5222 -1.5317 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2614 -0.8204 1.4992 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8494 0.8244 1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6709 2.9773 0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7244 3.9518 -1.3588 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9529 2.7307 -2.6192 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1738 0.5731 -1.7718 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 8 10 1 0 8 11 1 0 6 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 19 21 1 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 13 3 1 0 21 15 1 0 27 22 1 0 1 28 1 0 1 29 1 0 1 30 1 0 4 31 1 0 5 32 1 0 12 33 1 0 14 34 1 0 14 35 1 0 16 36 1 0 16 37 1 0 17 38 1 0 17 39 1 0 18 40 1 0 18 41 1 0 19 42 1 0 20 43 1 0 20 44 1 0 21 45 1 0 23 46 1 0 24 47 1 0 25 48 1 0 26 49 1 0 27 50 1 0 M END