HMDB0014682 RDKit 3D Benazepril 59 61 0 0 0 0 0 0 0 0999 V2000 3.3716 2.6035 2.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9419 2.3468 1.7601 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8692 1.1210 1.0909 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6963 0.6035 0.5357 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3107 1.3462 0.6899 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7162 -0.6787 -0.1438 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1162 -1.0836 -0.5494 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0914 -1.2850 0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4212 -1.7078 -0.0413 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3781 -0.8025 -0.3932 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5705 -1.2501 -0.9261 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8504 -2.5876 -1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8655 -3.4817 -0.7605 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6709 -3.0500 -0.2276 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1043 -0.7673 -1.2762 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5079 -0.6668 -1.2236 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.2093 -1.6677 -0.3694 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5241 -1.2681 1.0152 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7084 -0.3691 1.1628 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5994 -0.7863 2.1159 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7175 -0.0149 2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9247 1.1429 1.5865 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0075 1.5520 0.6207 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8860 0.7780 0.4129 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0867 1.3692 -0.6058 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3324 2.7428 -0.9986 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3068 2.8464 -2.1241 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6593 3.9185 -2.6235 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8321 1.6634 -2.6201 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0185 0.6839 -1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4221 1.4632 -2.1102 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0679 2.0910 1.5113 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5478 2.2148 3.2442 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6319 3.6689 2.1991 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7050 3.1615 1.0493 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2742 2.4196 2.6403 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3828 -1.5024 0.6138 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -2.0284 -1.1711 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5614 -0.3346 -1.2545 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7843 -2.1534 1.2091 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 -0.4403 1.1767 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1703 0.2504 -0.2416 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3160 -0.5091 -1.1977 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8054 -2.9291 -1.5502 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0464 -4.5499 -0.9015 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8983 -3.7761 0.0571 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1839 -1.5468 -1.9147 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8025 -1.0753 -2.3067 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1666 -2.0326 -0.8283 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5555 -2.5695 -0.3269 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7906 -2.1988 1.5726 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6966 -0.8236 1.5967 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4023 -1.6865 2.6627 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4768 -0.2810 3.0674 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8050 1.7703 1.7352 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1693 2.4332 0.0655 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4625 3.4556 -0.1938 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3627 3.0690 -1.4766 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5008 1.1892 -3.4411 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 1 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 6 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 25 30 1 0 30 31 2 0 14 9 1 0 30 16 1 0 24 19 1 0 1 32 1 0 1 33 1 0 1 34 1 0 2 35 1 0 2 36 1 0 6 37 1 1 7 38 1 0 7 39 1 0 8 40 1 0 8 41 1 0 10 42 1 0 11 43 1 0 12 44 1 0 13 45 1 0 14 46 1 0 15 47 1 0 16 48 1 6 17 49 1 0 17 50 1 0 18 51 1 0 18 52 1 0 20 53 1 0 21 54 1 0 22 55 1 0 23 56 1 0 26 57 1 0 26 58 1 0 29 59 1 0 M END