HMDB0259462 RDKit 3D Disopiramide 54 55 0 0 0 0 0 0 0 0999 V2000 2.6536 1.1727 -1.8869 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7632 -0.2454 -1.4648 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2124 -0.6540 -1.5147 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1521 -0.5670 -0.1875 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7737 -0.3389 -0.2373 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0487 -0.5220 0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5367 -0.2912 0.7666 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2024 -0.5005 2.0924 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6104 -0.4093 2.2495 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4814 -0.7618 3.0776 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8411 1.0959 0.2915 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8235 1.4718 -1.0197 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1118 2.7796 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 3.7278 -0.4759 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4451 3.3551 0.8559 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 2.0547 1.2399 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -1.2881 -0.1371 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6204 -2.5352 -0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2267 -3.4544 -1.1817 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 -3.0854 -1.8535 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8788 -1.8261 -1.6556 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2685 -0.9718 -0.8145 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9521 -0.2518 0.9086 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 1.2086 1.1619 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7164 -0.9295 2.2119 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2024 1.2629 -2.9209 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0266 1.8303 -1.2644 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6712 1.6461 -2.0298 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 -0.8788 -2.2306 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3996 -1.6725 -1.1316 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8746 0.1214 -1.0755 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 -0.6884 -2.6036 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4966 0.6550 -0.6809 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3521 -1.0669 -1.0026 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0327 -1.4655 1.5126 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3053 0.2632 1.7277 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1791 0.2552 1.6708 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1489 -0.9865 2.9364 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5858 0.7400 -1.7806 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0949 3.0614 -2.4693 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6512 4.7400 -0.7811 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 4.1174 1.5797 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1855 1.8197 2.2766 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7278 -2.7901 0.2319 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7857 -4.4235 -1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8274 -3.8114 -2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7772 -1.5832 -2.2064 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0083 -0.6518 0.5976 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7729 1.7233 0.3573 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9932 1.2073 2.0222 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3628 1.7197 1.5737 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2085 -0.2884 2.9599 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7092 -1.1654 2.7262 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2325 -1.9243 2.1557 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 2 0 7 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 7 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 4 23 1 0 23 24 1 0 23 25 1 0 16 11 1 0 22 17 1 0 1 26 1 0 1 27 1 0 1 28 1 0 2 29 1 0 3 30 1 0 3 31 1 0 3 32 1 0 5 33 1 0 5 34 1 0 6 35 1 0 6 36 1 0 9 37 1 0 9 38 1 0 12 39 1 0 13 40 1 0 14 41 1 0 15 42 1 0 16 43 1 0 18 44 1 0 19 45 1 0 20 46 1 0 21 47 1 0 23 48 1 0 24 49 1 0 24 50 1 0 24 51 1 0 25 52 1 0 25 53 1 0 25 54 1 0 M END