HMDB0031009 RDKit 3D Adipostatin A 59 59 0 0 0 0 0 0 0 0999 V2000 4.3556 3.1975 2.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7725 2.1206 1.7197 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9230 1.3126 1.2294 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5288 0.1923 0.2932 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5936 -0.7458 1.0096 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1366 -1.8957 0.1794 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 -1.5018 -1.0636 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1547 -0.7128 -0.8102 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1233 -1.3952 0.0153 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4361 -2.6524 -0.4748 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 -2.8122 -1.7616 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3113 -2.0459 -2.1099 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0931 -0.5813 -2.2359 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4130 0.0747 -2.6039 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4685 -0.0649 -1.5542 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0680 0.6010 -0.2854 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4192 -0.0021 0.7567 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0808 0.7156 1.9056 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4269 0.0483 2.9206 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3811 2.0428 2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0298 2.6633 1.0068 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3500 4.0103 1.1083 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3644 1.9573 -0.1272 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8839 2.6583 3.4589 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0461 3.8042 2.0299 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4952 3.7950 3.0366 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2558 2.5796 0.8537 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0326 1.5853 2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5938 1.9832 0.6553 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4868 0.8484 2.0713 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4694 -0.3309 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1131 0.5837 -0.6522 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7128 -0.2242 1.4346 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1521 -1.1572 1.8767 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0414 -2.4857 -0.1003 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4612 -2.5188 0.7995 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0159 -0.9173 -1.7722 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1053 -2.4269 -1.6032 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3888 0.2612 -0.3021 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7406 -0.4307 -1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6327 -0.6920 0.3641 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -1.6836 1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2025 -2.9686 0.3348 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2989 -3.5214 -0.3712 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4025 -3.9176 -1.9134 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3322 -2.7175 -2.6353 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0861 -2.2086 -1.2958 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8036 -2.4622 -3.0459 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -0.3841 -3.1585 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6011 -0.0813 -1.4223 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7419 -0.4396 -3.5465 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1885 1.1056 -2.8795 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7299 -1.1115 -1.3315 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4022 0.4442 -1.9402 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1677 -1.0507 0.6954 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4117 0.0362 2.8994 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1163 2.6021 2.9355 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8260 4.4769 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8779 2.4400 -0.9487 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 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 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 2 0 17 18 1 0 18 19 1 0 18 20 2 0 20 21 1 0 21 22 1 0 21 23 2 0 23 16 1 0 1 24 1 0 1 25 1 0 1 26 1 0 2 27 1 0 2 28 1 0 3 29 1 0 3 30 1 0 4 31 1 0 4 32 1 0 5 33 1 0 5 34 1 0 6 35 1 0 6 36 1 0 7 37 1 0 7 38 1 0 8 39 1 0 8 40 1 0 9 41 1 0 9 42 1 0 10 43 1 0 10 44 1 0 11 45 1 0 11 46 1 0 12 47 1 0 12 48 1 0 13 49 1 0 13 50 1 0 14 51 1 0 14 52 1 0 15 53 1 0 15 54 1 0 17 55 1 0 19 56 1 0 20 57 1 0 22 58 1 0 23 59 1 0 M END