HMDB0015637 RDKit 3D Vilazodone 60 64 0 0 0 0 0 0 0 0999 V2000 -5.0292 4.2772 -2.9365 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3880 3.5232 -2.1377 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8395 2.5737 -1.1576 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1118 2.7342 -0.6484 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5507 1.8294 0.2902 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7582 0.7896 0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9316 -0.2218 1.6127 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8398 -0.9901 1.6779 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8944 -0.4936 0.8093 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5092 -1.0347 0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4598 -1.7725 -0.7462 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1461 -2.3823 -1.1141 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0013 -1.4256 -1.2707 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6568 -0.6801 -0.1147 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0934 -1.3943 0.9744 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -1.6668 0.8216 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0267 -0.5019 0.3086 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4572 -0.4977 0.4083 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1785 -1.5198 0.9645 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5534 -1.4985 1.0506 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2715 -0.4239 0.5696 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5514 -0.1418 0.5197 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7760 1.0207 -0.0394 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0573 1.6709 -0.2702 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2440 1.0232 0.1474 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0847 2.7990 -0.8384 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5214 1.5325 -0.3806 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5629 0.6142 0.0061 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1867 0.5804 -0.0737 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4066 0.6410 -0.2857 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 0.6017 -0.3636 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4738 0.6083 0.2216 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0537 1.5278 -0.7195 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7288 3.5545 -0.9913 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5417 1.9450 0.6943 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8073 -0.3838 2.1811 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7210 -1.8582 2.3093 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7885 -0.1642 0.5306 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2233 -1.6666 1.3828 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6961 -1.0343 -1.5735 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2969 -2.5150 -0.8327 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3014 -2.8239 -2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8461 -3.2024 -0.4154 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1523 -2.0017 -1.7037 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2498 -0.6723 -2.0801 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2728 -0.8296 1.9155 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6868 -2.3374 1.0964 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7488 -1.8930 1.8606 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5194 -2.5584 0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6578 -2.3910 1.3601 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0566 -2.3330 1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7930 1.4958 0.9226 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5751 0.1346 -0.2696 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3128 2.4804 -0.8636 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6537 1.3973 -0.5147 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8075 0.7122 -1.3345 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7687 1.5587 0.2536 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4818 0.9762 -1.3443 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4838 1.3160 0.4039 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0482 1.3926 -1.1156 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 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 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 24 26 2 0 23 27 2 0 27 28 1 0 28 29 2 0 17 30 1 0 30 31 1 0 9 32 1 0 32 33 2 0 33 3 1 0 32 6 1 0 31 14 1 0 29 18 1 0 28 21 1 0 4 34 1 0 5 35 1 0 7 36 1 0 8 37 1 0 10 38 1 0 10 39 1 0 11 40 1 0 11 41 1 0 12 42 1 0 12 43 1 0 13 44 1 0 13 45 1 0 15 46 1 0 15 47 1 0 16 48 1 0 16 49 1 0 19 50 1 0 20 51 1 0 25 52 1 0 25 53 1 0 27 54 1 0 29 55 1 0 30 56 1 0 30 57 1 0 31 58 1 0 31 59 1 0 33 60 1 0 M END