HMDB0015187 RDKit 3D Nitrendipine 46 47 0 0 0 0 0 0 0 0999 V2000 5.3306 -2.2724 0.2618 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8973 -2.4956 0.7014 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1777 -1.3373 0.4244 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8437 -1.1297 0.6708 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2156 -2.0867 1.1999 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1889 0.1346 0.3363 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8987 1.0985 -0.2154 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3647 0.9320 -0.5101 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3219 2.3284 -0.5557 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0658 2.5598 -0.3059 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 3.8753 -0.6748 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7937 1.6138 0.2434 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2225 1.8685 0.4944 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9390 0.9584 1.0264 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8763 3.0372 0.1975 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2440 3.2727 0.4411 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2284 0.3095 0.6157 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0883 -0.7398 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1566 -0.8874 -1.3679 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9462 -1.8527 -1.9564 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6981 -2.7077 -1.1919 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6515 -2.5860 0.1819 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4163 -3.4547 0.9845 N 0 0 0 0 0 4 0 0 0 0 0 0 -3.3609 -3.3293 2.2191 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2051 -4.4189 0.3933 O 0 0 0 0 0 1 0 0 0 0 0 0 -1.8519 -1.6094 0.7615 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9912 -1.9705 1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6853 -3.2107 -0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3572 -1.4816 -0.5079 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9489 -2.7327 1.7957 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4458 -3.3657 0.1687 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7368 1.8987 -0.9646 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5219 0.1602 -1.2687 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9728 0.8040 0.3926 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8846 3.1184 -1.0032 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1215 4.4538 -1.2268 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0863 4.4343 0.1555 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4364 3.6727 -1.4419 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7010 2.4474 1.0255 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3804 4.1976 1.0736 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8287 3.4560 -0.4822 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3577 0.2102 1.7345 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 -0.2175 -1.9786 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9859 -1.9515 -3.0272 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3113 -3.4583 -1.6704 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8419 -1.5458 1.8327 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 2 0 4 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 1 0 10 11 1 0 10 12 2 0 12 13 1 0 13 14 2 0 13 15 1 0 15 16 1 0 12 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 2 0 23 25 1 0 22 26 2 0 17 6 1 0 26 18 1 0 1 27 1 0 1 28 1 0 1 29 1 0 2 30 1 0 2 31 1 0 8 32 1 0 8 33 1 0 8 34 1 0 9 35 1 0 11 36 1 0 11 37 1 0 11 38 1 0 16 39 1 0 16 40 1 0 16 41 1 0 17 42 1 0 19 43 1 0 20 44 1 0 21 45 1 0 26 46 1 0 M CHG 2 23 1 25 -1 M END