HMDB0304849 RDKit 3D Vericiguat 47 50 0 0 0 0 0 0 0 0999 V2000 8.3152 -0.7006 -0.5306 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0742 -1.0853 -1.0554 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8619 -0.6471 -0.4706 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0106 0.0880 0.5208 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6265 -1.0250 -0.9856 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3387 -0.6916 -0.5631 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9683 0.4676 0.0656 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8967 1.5204 0.2714 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6673 0.6347 0.4721 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -0.2848 0.2832 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6302 -0.0822 0.7225 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 -0.9451 0.5865 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7644 -0.4379 1.1018 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0873 -1.0284 1.1686 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8741 -0.6707 -0.0375 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8548 0.2870 0.0404 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5860 0.6214 -1.0733 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3501 0.0083 -2.2729 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3724 -0.9525 -2.3691 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6479 -1.2785 -1.2491 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6907 -2.2343 -1.3907 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.4424 0.7968 1.5877 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1723 1.7474 2.2102 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6034 2.9080 2.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2683 3.1900 2.3892 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7597 4.3750 2.8044 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.4914 2.2319 1.7511 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1054 1.0560 1.3668 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0912 -1.4189 -0.3328 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3303 -1.6580 -0.7564 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6513 -2.8828 -1.4047 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9563 -1.6014 -0.4413 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1520 -0.2785 0.4913 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8358 0.0751 -1.1235 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6632 -1.6740 -1.8509 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0872 1.8490 1.2398 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3917 1.9843 -0.5187 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6284 -0.6653 2.0714 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9650 -2.1231 1.2825 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0707 0.8014 0.9944 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3492 1.3871 -0.9506 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9698 0.3250 -3.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2056 -1.4196 -3.3214 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2017 3.6765 3.1045 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5445 2.4182 1.5734 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4922 -3.0307 -2.4148 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0605 -3.6332 -0.8010 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 3 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 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 19 20 2 0 20 21 1 0 13 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 25 26 1 0 25 27 1 0 27 28 2 0 10 29 1 0 29 30 2 0 30 31 1 0 30 6 1 0 28 11 1 0 20 15 1 0 28 22 1 0 1 32 1 0 1 33 1 0 1 34 1 0 5 35 1 0 8 36 1 0 8 37 1 0 14 38 1 0 14 39 1 0 16 40 1 0 17 41 1 0 18 42 1 0 19 43 1 0 24 44 1 0 27 45 1 0 31 46 1 0 31 47 1 0 M END