HMDB0014552 RDKit 3D Loxapine 41 44 0 0 0 0 0 0 0 0999 V2000 3.5793 -1.7879 0.3844 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7041 -0.6292 -0.4831 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6273 0.5892 0.2592 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2086 0.8495 0.7758 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2879 0.5000 -0.2736 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0846 0.2620 -0.0336 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4772 -0.9836 0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7491 -1.5753 0.2127 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8281 -2.9067 -0.1344 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0026 -3.6499 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1021 -2.9974 0.5147 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0444 -1.6694 0.8671 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8889 -0.9522 0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0426 0.3591 1.1344 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2583 1.4294 0.6715 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9427 2.6252 0.7782 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 3.7779 0.3631 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 3.7527 -0.1452 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 5.2248 -0.6694 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.3259 2.5611 -0.2591 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9677 1.4075 0.1586 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7837 0.3853 -1.6225 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8465 -0.6939 -1.6222 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.9199 0.7612 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9055 -2.7131 -0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2649 -1.6544 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9421 1.4284 -0.3728 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3369 0.5275 1.1024 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0355 0.1940 1.6561 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1767 1.8887 1.1001 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 -3.3870 -0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0402 -4.6955 -0.2727 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0328 -3.5187 0.6455 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9302 -1.1976 1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9423 2.7044 1.1668 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8428 4.7258 0.4449 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 2.5367 -0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2415 1.3151 -2.0123 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9809 0.1129 -2.3373 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4647 -0.5236 -2.5446 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4042 -1.7017 -1.7199 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 2 0 7 8 1 0 8 9 2 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 2 0 16 17 1 0 17 18 2 0 18 19 1 0 18 20 1 0 20 21 2 0 5 22 1 0 22 23 1 0 23 2 1 0 21 6 1 0 13 8 1 0 21 15 1 0 1 24 1 0 1 25 1 0 1 26 1 0 3 27 1 0 3 28 1 0 4 29 1 0 4 30 1 0 9 31 1 0 10 32 1 0 11 33 1 0 12 34 1 0 16 35 1 0 17 36 1 0 20 37 1 0 22 38 1 0 22 39 1 0 23 40 1 0 23 41 1 0 M END