HMDB0289276 RDKit 3D PC(18:1(9Z)-O(12,13)/DiMe(9,3)) 134135 0 0 0 0 0 0 0 0999 V2000 -10.6069 -4.9662 -4.3696 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2138 -5.5088 -4.6739 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5485 -4.5667 -5.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4039 -3.1593 -5.0974 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5791 -3.2045 -3.8297 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3741 -1.8449 -3.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4897 -1.1007 -2.8584 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7802 -1.6658 -1.7965 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8229 -0.7575 -1.0432 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1374 -0.5195 0.3546 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3043 -0.7997 1.3304 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9518 -1.3845 1.2261 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8788 -2.6660 2.0463 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4840 -3.2978 1.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1220 -3.7156 0.6125 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7727 -4.2989 0.4322 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -3.4965 0.5217 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2219 -2.7548 1.7499 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1006 -2.0590 1.5513 C 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1 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 49 53 2 0 53 54 1 0 53 55 1 0 55 56 1 0 8 6 1 0 55 47 2 0 1 57 1 0 1 58 1 0 1 59 1 0 2 60 1 0 2 61 1 0 3 62 1 0 3 63 1 0 4 64 1 0 4 65 1 0 5 66 1 0 5 67 1 0 6 68 1 0 8 69 1 0 9 70 1 0 9 71 1 0 10 72 1 0 11 73 1 0 12 74 1 0 12 75 1 0 13 76 1 0 13 77 1 0 14 78 1 0 14 79 1 0 15 80 1 0 15 81 1 0 16 82 1 0 16 83 1 0 17 84 1 0 17 85 1 0 18 86 1 0 18 87 1 0 22 88 1 0 22 89 1 0 23 90 1 1 24 91 1 0 24 92 1 0 30 93 1 0 30 94 1 0 31 95 1 0 31 96 1 0 33 97 1 0 33 98 1 0 33 99 1 0 34100 1 0 34101 1 0 34102 1 0 35103 1 0 35104 1 0 35105 1 0 39106 1 0 39107 1 0 40108 1 0 40109 1 0 41110 1 0 41111 1 0 42112 1 0 42113 1 0 43114 1 0 43115 1 0 44116 1 0 44117 1 0 45118 1 0 45119 1 0 46120 1 0 46121 1 0 50122 1 0 50123 1 0 51124 1 0 51125 1 0 52126 1 0 52127 1 0 52128 1 0 54129 1 0 54130 1 0 54131 1 0 56132 1 0 56133 1 0 56134 1 0 M CHG 2 28 -1 32 1 M END