HMDB0015542 RDKit 3D Pivampicillin 61 63 0 0 0 0 0 0 0 0999 V2000 5.9728 2.2499 1.5094 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3574 1.5143 0.2367 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8391 1.2625 0.2074 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9748 2.3888 -0.9631 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6301 0.2295 0.2439 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2613 -0.8412 0.3295 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2583 0.2274 0.1584 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5878 -1.0235 0.1814 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1950 -0.8195 0.0638 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2314 -1.8036 0.0751 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6024 -2.9948 0.2068 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2156 -1.4001 -0.0724 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2316 -0.0263 -0.4066 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0119 1.0846 -1.2167 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7973 1.5796 -2.0392 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3054 1.6653 -0.6537 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4119 1.2050 -1.2882 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5067 0.7523 -1.9179 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1548 1.3302 -2.8681 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1491 -0.5786 -1.5589 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.9645 -1.0657 -2.6599 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1049 -0.2667 -0.4488 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0208 -1.2242 -0.1021 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9158 -0.9467 0.8944 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8917 0.2737 1.5339 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9850 1.2379 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0733 0.9417 0.1766 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8028 0.8796 0.5453 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0401 -0.1657 1.3260 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0455 -1.6986 1.1003 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3031 -1.9180 2.3801 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0214 -2.8301 0.9053 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0030 2.7615 1.4046 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8988 1.4710 2.3122 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7728 2.9591 1.7783 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0281 0.2738 0.6863 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1390 1.1380 -0.8708 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3817 2.0969 0.6748 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9940 2.1252 -1.3732 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8912 3.4492 -0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7687 2.3565 -1.7416 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8935 -1.5457 -0.7753 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8636 -1.6607 1.0198 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5917 -2.0707 -0.9063 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1022 2.7818 -0.5284 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3918 2.2988 -2.1074 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4026 -1.3217 -1.3169 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0146 -2.1089 -2.6709 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6719 -0.6561 -3.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0773 -2.2118 -0.5851 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6395 -1.7192 1.1525 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6024 0.5039 2.3317 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9848 2.1845 1.7147 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3605 1.7210 -0.0729 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1027 1.4037 1.2098 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0493 -0.9701 2.9159 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9869 -2.4703 3.0787 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5734 -2.5911 2.2611 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1346 -3.0224 -0.2014 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0443 -2.6044 1.2575 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6263 -3.7910 1.3378 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 2 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 20 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 16 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 30 32 1 0 30 12 1 0 28 13 1 0 27 22 1 0 1 33 1 0 1 34 1 0 1 35 1 0 3 36 1 0 3 37 1 0 3 38 1 0 4 39 1 0 4 40 1 0 4 41 1 0 8 42 1 0 8 43 1 0 12 44 1 6 16 45 1 1 17 46 1 0 20 47 1 1 21 48 1 0 21 49 1 0 23 50 1 0 24 51 1 0 25 52 1 0 26 53 1 0 27 54 1 0 28 55 1 1 31 56 1 0 31 57 1 0 31 58 1 0 32 59 1 0 32 60 1 0 32 61 1 0 M END