HMDB0006836 RDKit 3D Tetrahymanol 83 87 0 0 0 0 0 0 0 0999 V2000 5.3275 -0.2973 2.7161 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9372 -0.6530 1.2691 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3678 -2.1194 1.1205 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7702 0.2298 0.3971 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2042 1.5900 0.2898 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7076 1.6950 0.3373 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0251 0.3676 -0.0463 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4863 0.0593 -1.4188 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4717 -0.5748 1.0396 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7867 -1.9074 0.9284 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3122 -1.6270 1.2642 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7437 -0.7074 0.1674 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7098 -1.5614 -1.0434 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5518 0.5226 0.1190 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9376 1.5635 -0.7941 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3999 1.9076 -0.1062 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2415 0.6771 -0.2827 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7147 0.9329 -0.2157 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1566 1.7455 0.9484 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0191 1.7896 -1.4618 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5058 1.9189 -1.6855 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2311 0.6295 -1.7461 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.5956 0.8725 -1.7012 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8992 -0.2962 -0.6007 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7137 -0.0027 0.6073 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3384 -1.6913 -1.0914 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4349 -0.3568 -0.4236 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9865 -1.3456 0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5306 -1.6664 0.2725 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6963 -0.4051 0.5617 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7394 -0.2059 2.0282 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4004 0.8225 2.7519 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5040 -0.5785 3.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3040 -0.7137 2.9789 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9452 -2.5951 0.2393 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4960 -2.0736 1.0832 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1420 -2.6224 2.0833 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0273 -0.2588 -0.5708 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7792 0.3284 0.9034 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6387 2.0729 -0.6322 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5903 2.2395 1.1304 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3356 2.0355 1.3331 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4411 2.5053 -0.3791 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6206 0.2804 -2.1158 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2714 0.7751 -1.8172 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9128 -0.9360 -1.5743 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0441 -0.1090 1.9854 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 -2.5742 1.7526 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9281 -2.4425 0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3593 -1.1090 2.2417 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8168 -2.5946 1.2729 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3108 -2.5737 -0.7205 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6887 -1.8226 -1.4807 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0714 -1.2417 -1.8618 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4579 0.9990 1.1458 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4764 2.4987 -0.8579 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7659 1.1758 -1.8133 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1754 2.0480 0.9729 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 2.8050 -0.5912 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0748 0.3561 -1.3588 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7232 1.2232 1.7202 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2358 2.2529 1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8074 2.6272 0.6599 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5174 1.4075 -2.3508 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6648 2.8437 -1.3013 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0035 2.6037 -0.9895 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6033 2.4045 -2.7015 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0170 0.1063 -2.7046 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8426 1.7634 -2.0425 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3450 -0.5244 1.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7443 -0.4321 0.4192 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9161 1.0863 0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4372 -2.3958 -0.2643 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3384 -1.5787 -1.5941 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6339 -2.0135 -1.8817 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0258 -0.7691 -1.4002 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5268 -2.3277 0.4985 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1347 -1.0378 1.6481 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1719 -2.5317 0.8343 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5827 -1.8500 -0.8407 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7004 0.1747 2.4292 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0377 0.4202 2.4713 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6526 -1.2331 2.5004 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 1 0 7 8 1 6 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 6 12 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 1 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 24 26 1 0 24 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 1 9 2 1 0 30 12 1 0 14 7 1 0 30 17 1 0 27 18 1 0 1 32 1 0 1 33 1 0 1 34 1 0 3 35 1 0 3 36 1 0 3 37 1 0 4 38 1 0 4 39 1 0 5 40 1 0 5 41 1 0 6 42 1 0 6 43 1 0 8 44 1 0 8 45 1 0 8 46 1 0 9 47 1 1 10 48 1 0 10 49 1 0 11 50 1 0 11 51 1 0 13 52 1 0 13 53 1 0 13 54 1 0 14 55 1 1 15 56 1 0 15 57 1 0 16 58 1 0 16 59 1 0 17 60 1 6 19 61 1 0 19 62 1 0 19 63 1 0 20 64 1 0 20 65 1 0 21 66 1 0 21 67 1 0 22 68 1 6 23 69 1 0 25 70 1 0 25 71 1 0 25 72 1 0 26 73 1 0 26 74 1 0 26 75 1 0 27 76 1 6 28 77 1 0 28 78 1 0 29 79 1 0 29 80 1 0 31 81 1 0 31 82 1 0 31 83 1 0 M END