HMDB0256012 RDKit 3D Oxyfedrine 46 47 0 0 0 0 0 0 0 0999 V2000 7.6966 1.5298 -0.2702 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2987 1.4992 -0.1687 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5517 0.3689 0.0983 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0899 -0.8745 0.3061 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2969 -1.9839 0.5722 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9310 -1.8816 0.6396 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3573 -0.6443 0.4355 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8993 -0.4707 0.4824 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4266 0.6830 0.3550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -1.6104 0.6734 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4427 -1.0787 0.8294 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7123 -0.3303 -0.3397 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9735 0.3112 -0.4741 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5575 -0.1845 -1.8185 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9988 -0.1469 0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2406 -1.5176 0.3939 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2531 0.6050 0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3771 1.8830 0.0152 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6075 2.5494 -0.0202 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7656 1.9722 0.4415 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6474 0.6829 0.9468 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4511 0.0246 0.9867 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1530 0.4448 0.1728 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1885 1.4311 0.7477 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0324 2.4891 -0.7414 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0644 0.7081 -0.9292 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1811 -0.9939 0.2661 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7611 -2.9412 0.7252 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2860 -2.7335 0.8448 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0749 -2.3129 -0.1638 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2052 -2.1488 1.6278 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4111 -0.4723 1.7577 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0861 -1.9635 0.8999 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4138 -0.7694 -1.2212 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8911 1.3954 -0.4913 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6898 -0.3539 -2.4895 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0823 -1.1173 -1.6218 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1494 0.6175 -2.3065 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5391 -0.0641 1.5769 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1041 -1.7260 0.0093 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5032 2.4155 -0.3683 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6619 3.5527 -0.4142 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7231 2.4771 0.4197 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5762 0.2387 1.3066 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3765 -0.9870 1.3883 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7423 1.4284 0.0120 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 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 13 15 1 0 15 16 1 0 15 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 7 23 2 0 23 3 1 0 22 17 1 0 1 24 1 0 1 25 1 0 1 26 1 0 4 27 1 0 5 28 1 0 6 29 1 0 10 30 1 0 10 31 1 0 11 32 1 0 11 33 1 0 12 34 1 0 13 35 1 0 14 36 1 0 14 37 1 0 14 38 1 0 15 39 1 0 16 40 1 0 18 41 1 0 19 42 1 0 20 43 1 0 21 44 1 0 22 45 1 0 23 46 1 0 M END