HMDB0006271 RDKit 3D Zymosterol intermediate 2 72 75 0 0 0 0 0 0 0 0999 V2000 6.3518 -1.3330 -1.0321 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0588 -1.4729 0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5199 -2.6910 1.1534 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4042 -0.5250 1.0649 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9149 0.7152 0.4146 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3951 0.7245 0.5923 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7980 1.9700 -0.0479 C 0 0 1 0 0 0 0 0 0 0 0 0 3.1377 1.9436 -1.4881 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3931 2.1950 0.3217 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8178 3.4178 -0.3073 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 2.9914 -0.8124 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 1.9070 0.1438 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9553 0.9807 -0.2732 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0937 -0.0781 0.5365 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0869 -0.1864 1.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3094 0.0955 1.1868 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4264 1.0905 0.0805 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4778 0.4156 -1.2319 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1743 -1.0860 0.3653 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5843 -2.3838 -0.1245 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8761 -1.3776 1.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3397 -1.0332 1.6308 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0603 -1.6629 0.4673 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.3843 -2.9769 0.7025 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3072 -1.4782 -0.8377 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1874 -0.5154 -0.5777 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5288 -0.0159 -1.8454 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7669 1.2365 -1.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3821 -1.2433 -1.5986 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0240 -0.4771 -1.2361 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8307 -2.2530 -1.4133 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2811 -2.4405 1.9353 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6887 -3.1953 1.7008 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9696 -3.4173 0.4478 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2026 -0.6439 2.1226 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0940 0.6260 -0.6921 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3900 1.6195 0.7884 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0463 -0.2024 0.0926 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2167 0.7353 1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3916 2.8216 0.4088 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5734 2.5904 -2.1495 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2237 2.2260 -1.6353 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0984 0.8844 -1.8799 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3785 2.3799 1.4409 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 4.2399 0.4389 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4108 3.8803 -1.0901 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5149 2.6864 -1.8761 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2903 3.8038 -0.6973 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0387 2.3249 1.1365 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -1.2272 2.0454 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4282 0.5001 2.4555 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7702 -0.8973 0.9139 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8572 0.5306 2.0739 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1077 -0.4743 -1.2828 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7177 1.0761 -2.0884 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5692 0.0467 -1.4567 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0942 -2.3193 -1.0949 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3968 -3.1393 -0.1644 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8922 -2.7394 0.6826 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4065 -0.7309 2.4467 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 -2.4370 1.9855 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7961 -1.4765 2.5575 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5323 0.0619 1.7187 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0284 -1.0920 0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1788 -3.5064 -0.1226 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9592 -1.0058 -1.6242 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9638 -2.4399 -1.2682 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6317 0.3792 -0.0845 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2784 0.1705 -2.6396 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7704 -0.7510 -2.2103 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5537 1.9884 -1.1723 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2204 1.6702 -2.3177 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 3 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 6 14 19 1 0 19 20 1 6 19 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 23 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 17 9 1 0 26 19 1 0 17 12 1 0 28 13 1 0 1 29 1 0 1 30 1 0 1 31 1 0 3 32 1 0 3 33 1 0 3 34 1 0 4 35 1 0 5 36 1 0 5 37 1 0 6 38 1 0 6 39 1 0 7 40 1 1 8 41 1 0 8 42 1 0 8 43 1 0 9 44 1 1 10 45 1 0 10 46 1 0 11 47 1 0 11 48 1 0 12 49 1 1 15 50 1 0 15 51 1 0 16 52 1 0 16 53 1 0 18 54 1 0 18 55 1 0 18 56 1 0 20 57 1 0 20 58 1 0 20 59 1 0 21 60 1 0 21 61 1 0 22 62 1 0 22 63 1 0 23 64 1 6 24 65 1 0 25 66 1 0 25 67 1 0 26 68 1 1 27 69 1 0 27 70 1 0 28 71 1 0 28 72 1 0 M END