HMDB0001919 RDKit 3D Famotidine 35 35 0 0 0 0 0 0 0 0999 V2000 -6.9472 -1.7726 0.5643 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8817 -0.9129 0.1894 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0220 0.4684 0.4112 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8275 -1.4335 -0.3399 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7493 -0.5464 -0.7171 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5910 -0.8131 -1.2641 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7532 0.1361 -1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 -0.1206 -2.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8604 -0.3987 -0.9146 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1476 1.1139 0.0601 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 0.7560 1.0793 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4687 0.3341 0.3873 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1321 1.2215 -0.4947 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9449 -0.8303 0.5795 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3872 -1.3501 -0.2158 S 0 0 0 0 0 6 0 0 0 0 0 0 6.7085 -1.1761 0.8553 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6513 -0.4903 -1.4329 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1910 -2.7549 -0.6628 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1258 1.4196 -1.2117 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6852 1.1624 -0.5469 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.5154 -2.2543 -0.1519 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1131 -1.8818 1.5924 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2797 1.0930 -0.3647 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8663 0.8538 1.3525 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 -1.0079 -2.8207 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0957 0.7420 -2.7799 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2348 1.2946 0.6418 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4292 1.9657 -0.5587 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3993 1.6589 1.7323 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8025 -0.0504 1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8876 1.1888 -1.5025 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8413 1.8729 -0.0927 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4939 -1.6318 1.7469 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0492 -0.2081 0.9065 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5544 2.3519 -1.3578 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 3 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 1 0 12 14 2 3 14 15 1 0 15 16 1 0 15 17 2 0 15 18 2 0 7 19 2 0 19 20 1 0 20 5 1 0 1 21 1 0 1 22 1 0 3 23 1 0 3 24 1 0 8 25 1 0 8 26 1 0 10 27 1 0 10 28 1 0 11 29 1 0 11 30 1 0 13 31 1 0 13 32 1 0 16 33 1 0 16 34 1 0 19 35 1 0 M END