HMDB0257073 RDKit 3D R-Doxazosin 58 62 0 0 0 0 0 0 0 0999 V2000 7.0347 -2.5223 1.1199 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2323 -1.2618 0.5061 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1205 -0.4968 0.1983 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8320 -0.9019 0.4599 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7709 -0.0639 0.1144 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4958 -0.4170 0.3503 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4798 0.3945 0.0151 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1535 -0.0495 0.2971 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0691 -1.3370 0.9262 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8937 -2.1300 -0.0981 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1837 -1.4368 -0.1881 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3435 -2.2365 -0.3191 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1831 -3.5037 -0.3516 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7257 -1.7642 -0.4226 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6532 -2.4660 0.5506 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8567 -1.7802 0.7307 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0114 -0.4124 0.6168 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1651 0.2366 1.0601 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2893 1.6088 0.9316 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2639 2.3339 0.3614 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1326 1.6729 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9783 0.3034 0.0443 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8601 -0.3718 -0.3791 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2837 -0.0121 -0.1468 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0045 0.7346 -0.0199 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7051 1.5970 -0.5724 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9532 2.0118 -0.8364 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2343 3.2642 -1.4507 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9939 1.1594 -0.4829 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2961 1.5642 -0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3479 0.7351 -0.4033 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6439 1.1266 -0.6588 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8686 2.3793 -1.2702 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4859 -3.2142 0.4232 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0183 -3.0023 1.3449 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3968 -2.4467 2.0235 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6410 -1.8480 0.9228 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6554 -1.1548 1.8438 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8772 -1.8787 1.1351 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3402 -2.0368 -1.0587 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 -3.1715 0.2289 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0911 -2.0768 -1.4458 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9209 -3.4976 0.1904 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0911 -2.5816 1.5007 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9493 -0.3669 1.5028 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1995 2.0669 1.2886 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3934 3.4024 0.2765 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3148 2.2196 -0.5205 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7915 0.3849 -1.0706 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9393 0.3285 0.7072 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7429 1.3036 -0.9559 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0496 1.5469 0.7648 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9097 4.1837 -1.0926 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8063 3.2643 -2.3222 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4373 2.5178 -1.2089 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3634 3.1453 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3572 2.3696 -2.2556 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9257 2.5836 -1.4484 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 9 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 11 24 1 0 24 25 1 0 7 26 2 0 26 27 1 0 27 28 1 0 27 29 2 0 29 30 1 0 30 31 2 0 31 32 1 0 32 33 1 0 31 3 1 0 29 5 1 0 25 8 1 0 23 14 1 0 22 17 1 0 1 34 1 0 1 35 1 0 1 36 1 0 4 37 1 0 9 38 1 0 9 39 1 0 10 40 1 0 10 41 1 0 14 42 1 0 15 43 1 0 15 44 1 0 18 45 1 0 19 46 1 0 20 47 1 0 21 48 1 0 24 49 1 0 24 50 1 0 25 51 1 0 25 52 1 0 28 53 1 0 28 54 1 0 30 55 1 0 33 56 1 0 33 57 1 0 33 58 1 0 M END