HMDB0256345 RDKit 3D Periplogenin 62 66 0 0 0 0 0 0 0 0999 V2000 2.2309 2.2347 0.2222 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1884 0.7517 -0.2126 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9104 0.7336 -1.5368 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8054 -0.4906 -1.6695 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8644 -0.2851 -0.6163 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9062 -1.1998 -0.7354 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2798 -0.2953 0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8268 -0.0230 0.8691 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6715 0.6886 2.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1092 -1.3445 1.1943 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6622 -1.1547 1.4977 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0599 0.0693 0.9056 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7479 0.4361 -0.4153 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4183 -0.6784 -1.3248 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0455 -0.4723 -1.7248 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9508 -0.5308 -0.5063 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2585 -2.0117 -0.3412 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1365 0.3122 -0.8451 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3794 0.1011 -0.1356 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9670 0.9954 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2130 0.4667 1.1952 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0106 1.0861 1.9734 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3473 -0.7998 0.7360 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2527 -1.1261 -0.0924 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6030 1.7028 -0.6078 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8245 1.5601 0.6603 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3982 0.0855 0.7129 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0473 -0.4739 1.8272 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 2.3796 1.1997 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2800 2.5294 0.1519 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6455 2.7694 -0.5502 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6362 1.5995 -1.6331 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2346 0.8620 -2.4063 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2486 -0.4193 -2.6964 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2748 -1.4349 -1.6116 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3099 0.7184 -0.8068 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6933 -0.7915 -0.2686 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5212 -1.3052 1.1946 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9044 0.4045 1.3769 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4456 1.2674 2.2167 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3518 -2.1361 0.4836 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6050 -1.6732 2.1597 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 -1.0855 2.6138 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1158 -2.1049 1.2218 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3252 0.9262 1.5941 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2206 1.3654 -0.7682 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0488 -0.7779 -2.2186 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4211 -1.6809 -0.8497 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2948 -1.3094 -2.4178 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0895 0.4585 -2.2829 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4425 -2.3012 0.7109 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9957 -2.3374 -1.0722 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3371 -2.6195 -0.6079 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3638 0.2410 -1.9567 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6535 2.0359 0.8699 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7639 -1.9763 0.4268 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6522 -1.3823 -1.0796 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9665 2.0515 -1.4612 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3545 2.4807 -0.4825 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4015 1.8503 1.5528 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9355 2.2431 0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5357 -1.1849 2.2451 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 5 7 1 0 7 8 1 0 8 9 1 0 8 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 1 0 16 18 1 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 21 23 1 0 23 24 1 0 18 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 8 2 1 0 27 12 1 0 13 2 1 0 27 16 1 0 24 19 1 0 1 29 1 0 1 30 1 0 1 31 1 0 3 32 1 0 3 33 1 0 4 34 1 0 4 35 1 0 5 36 1 0 6 37 1 0 7 38 1 0 7 39 1 0 9 40 1 0 10 41 1 0 10 42 1 0 11 43 1 0 11 44 1 0 12 45 1 0 13 46 1 0 14 47 1 0 14 48 1 0 15 49 1 0 15 50 1 0 17 51 1 0 17 52 1 0 17 53 1 0 18 54 1 0 20 55 1 0 24 56 1 0 24 57 1 0 25 58 1 0 25 59 1 0 26 60 1 0 26 61 1 0 28 62 1 0 M END