HMDB0247455 RDKit 3D 8-OH-Dpat 43 44 0 0 0 0 0 0 0 0999 V2000 -2.7133 3.5178 0.4479 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6671 2.1583 -0.2797 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 1.4720 0.2514 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2248 0.1498 -0.3631 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 -0.7473 0.0855 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4763 -2.0180 -0.6412 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6363 -2.8082 0.0468 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1102 -0.1774 0.0688 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4003 -1.6541 0.1605 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7962 -1.8583 0.6865 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7778 -0.8658 0.3287 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0873 -1.0985 0.7674 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0807 -0.2006 0.4719 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8073 0.9293 -0.2536 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4936 1.1658 -0.6952 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2779 2.3185 -1.4217 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5071 0.2565 -0.3912 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1077 0.4945 -0.8494 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7223 3.9440 0.4582 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9487 4.1974 0.0162 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4055 3.3057 1.4902 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5859 2.4112 -1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6253 1.6879 0.0029 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5936 2.1030 0.0195 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5349 1.3347 1.3277 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9899 -0.9545 1.1741 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2509 -0.2573 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7003 -2.7457 -0.7283 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8572 -1.8037 -1.6819 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6744 -3.7627 -0.5084 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3077 -3.0014 1.0956 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5596 -2.2308 0.0375 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2433 0.2212 1.1019 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3843 -2.0499 -0.8525 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2692 -2.0921 0.9098 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1684 -2.8507 0.2882 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8155 -2.0091 1.8046 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3422 -1.9730 1.3355 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0988 -0.3869 0.8119 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5742 1.6481 -0.4985 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3752 2.5337 -1.7669 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0408 0.1221 -1.8811 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9515 1.5745 -0.8079 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 4 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 15 17 2 0 17 18 1 0 18 8 1 0 17 11 1 0 1 19 1 0 1 20 1 0 1 21 1 0 2 22 1 0 2 23 1 0 3 24 1 0 3 25 1 0 5 26 1 0 5 27 1 0 6 28 1 0 6 29 1 0 7 30 1 0 7 31 1 0 7 32 1 0 8 33 1 0 9 34 1 0 9 35 1 0 10 36 1 0 10 37 1 0 12 38 1 0 13 39 1 0 14 40 1 0 16 41 1 0 18 42 1 0 18 43 1 0 M END