HMDB0257236 RDKit 3D Riociguat 50 53 0 0 0 0 0 0 0 0999 V2000 4.6942 3.2449 -0.8103 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2361 1.9180 -0.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1039 0.8534 -1.0195 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3391 1.0353 -1.1992 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6280 -0.4859 -1.0252 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5168 -1.5970 -1.2248 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2268 -0.6673 -0.8092 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8163 -1.1866 0.4295 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7733 -1.5352 1.4121 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5051 -1.3272 0.6497 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5363 -1.0151 -0.2135 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8773 -1.1392 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9387 -0.8717 -0.6644 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0464 -1.0593 -0.0016 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4431 -0.8411 -0.4294 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8094 0.5703 -0.2659 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5196 1.0293 0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8224 2.3688 0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4051 3.2740 -0.0215 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7016 2.8309 -1.0945 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3920 1.4876 -1.2393 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6985 0.9959 -2.3001 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.7424 -1.4643 1.2495 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4616 -1.8005 2.3316 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8642 -2.1828 3.4739 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4944 -2.2476 3.5882 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7291 -1.9093 2.4951 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3765 -1.5225 1.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9522 -0.5162 -1.4074 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2461 -0.3483 -1.6952 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 0.1974 -2.9616 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0437 3.8752 -1.4554 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7531 3.2803 -1.0936 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5508 3.6398 0.2313 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9588 -1.5562 -2.2396 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2646 -1.6868 -0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9070 -2.5427 -1.1567 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9356 -2.5350 1.6197 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3084 -0.8041 1.9204 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1403 -1.4261 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5703 -1.1878 -1.4724 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8696 0.3555 1.6102 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3802 2.7561 1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6464 4.3345 0.0831 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3764 3.5275 -1.8506 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4389 -2.4668 4.3741 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9921 -2.5581 4.5171 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3422 -1.9497 2.5449 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2550 -0.2747 -3.6303 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2282 1.1306 -3.2571 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 5 7 1 0 7 8 2 0 8 9 1 0 8 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 14 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 11 29 1 0 29 30 2 0 30 31 1 0 30 7 1 0 28 12 1 0 21 16 1 0 28 23 1 0 1 32 1 0 1 33 1 0 1 34 1 0 6 35 1 0 6 36 1 0 6 37 1 0 9 38 1 0 9 39 1 0 15 40 1 0 15 41 1 0 17 42 1 0 18 43 1 0 19 44 1 0 20 45 1 0 25 46 1 0 26 47 1 0 27 48 1 0 31 49 1 0 31 50 1 0 M END