HMDB0015535 RDKit 3D Cilastatin 50 50 0 0 0 0 0 0 0 0999 V2000 -5.6916 0.7720 -2.9754 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5550 0.9819 -1.9826 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4421 2.3604 -1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3542 -0.1282 -0.9461 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4229 0.0228 -2.0688 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0457 0.5114 -1.8608 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1671 0.1277 -2.7204 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6461 1.3592 -0.7884 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 1.7915 -0.6404 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4121 1.5206 0.4629 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2017 0.7470 1.5606 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5754 -0.4350 1.9403 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8555 -1.5156 0.9966 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6343 -1.2468 -0.2304 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2625 -0.5781 -0.0288 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5079 -1.5551 0.7177 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3611 -1.8973 2.1748 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3080 -0.6704 2.9577 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6184 -2.5964 2.5718 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3452 -2.0747 3.4441 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0331 -3.7979 2.0277 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2993 2.5495 -1.7199 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5003 2.9695 -1.6467 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3755 2.8624 -2.8872 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2524 0.2509 -3.8563 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0658 1.7438 -3.2926 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4531 0.0919 -2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5261 2.8501 -1.7703 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3023 2.9797 -1.8442 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5724 2.3741 -0.3107 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0985 -0.9401 -0.9916 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0334 0.1761 0.0825 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5037 -0.7105 -2.9307 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3470 1.6571 -0.0983 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4082 1.8945 0.4676 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2425 1.4805 2.4306 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2791 0.5529 1.3594 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0517 -0.9265 2.8325 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5625 -0.1259 2.4303 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 -2.3303 1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1542 -1.9331 0.6712 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0678 -0.5969 -0.9224 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6977 -2.2289 -0.8221 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4965 -1.0235 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6684 -2.5019 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5485 -2.5833 2.4162 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2686 -0.3969 3.2582 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9717 0.0808 2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0806 -4.6009 2.6718 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1222 2.6859 -3.7651 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 2 0 6 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 17 19 1 0 19 20 2 0 19 21 1 0 9 22 1 0 22 23 2 0 22 24 1 0 5 2 1 0 1 25 1 0 1 26 1 0 1 27 1 0 3 28 1 0 3 29 1 0 3 30 1 0 4 31 1 0 4 32 1 0 5 33 1 6 8 34 1 0 10 35 1 0 11 36 1 0 11 37 1 0 12 38 1 0 12 39 1 0 13 40 1 0 13 41 1 0 14 42 1 0 14 43 1 0 16 44 1 0 16 45 1 0 17 46 1 6 18 47 1 0 18 48 1 0 21 49 1 0 24 50 1 0 M END