HMDB0014434 RDKit 3D Atomoxetine 40 41 0 0 0 0 0 0 0 0999 V2000 -3.5090 -2.5440 0.7809 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8148 -2.2423 2.0217 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0776 -0.9825 1.8982 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9415 -1.2042 0.9206 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1247 0.0543 0.7183 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8910 -0.2776 -0.2008 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2261 -0.0232 -0.0821 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8272 0.6204 0.9712 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2001 0.8270 0.9885 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9707 0.3814 -0.0633 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4009 -0.2687 -1.1368 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0343 -0.4624 -1.1316 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4183 -1.1742 -2.3024 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9796 1.0652 -0.0033 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3858 0.8778 -1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1679 1.8290 -1.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5749 2.9950 -1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1535 3.1619 0.0222 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3716 2.2120 0.6441 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3183 -3.2605 0.9544 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8247 -2.9235 -0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9540 -1.5947 0.4014 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1469 -3.0217 2.2355 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7202 -0.7410 2.9099 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7986 -0.2400 1.4928 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3289 -1.5422 -0.0437 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2958 -1.9963 1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2151 0.5147 1.6432 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1886 0.9549 1.7769 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6404 1.3435 1.8463 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0495 0.5396 -0.0574 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0238 -0.6207 -1.9729 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3949 -1.5278 -2.0122 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0063 -2.1011 -2.4824 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3351 -0.5397 -3.1916 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0967 -0.0174 -1.8528 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5062 1.7083 -2.9503 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1928 3.7341 -1.7914 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4521 4.0632 0.5559 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0865 2.4232 1.6683 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 5 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 12 13 1 0 5 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 12 7 1 0 19 14 1 0 1 20 1 0 1 21 1 0 1 22 1 0 2 23 1 0 3 24 1 0 3 25 1 0 4 26 1 0 4 27 1 0 5 28 1 1 8 29 1 0 9 30 1 0 10 31 1 0 11 32 1 0 13 33 1 0 13 34 1 0 13 35 1 0 15 36 1 0 16 37 1 0 17 38 1 0 18 39 1 0 19 40 1 0 M END