HMDB0113028 RDKit 3D PE-NMe(15:0/20:4(5Z,8Z,11Z,14Z)) 125124 0 0 0 0 0 0 0 0999 V2000 -10.5971 3.6275 3.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0487 3.6955 2.3367 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2024 2.3451 1.6686 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6680 2.0009 1.6395 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7687 0.6147 0.9518 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2163 0.7104 -0.4017 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2074 0.0093 -0.8296 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4742 -0.9791 -0.0301 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5725 -2.3013 -0.7536 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5067 -2.8878 -1.1745 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1348 -2.3949 -1.0301 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5659 -2.2543 -2.3687 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1333 -1.1456 -2.8855 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1477 0.1286 -2.2184 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9484 0.8669 -1.9234 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7160 0.5809 -2.1291 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2113 -0.6362 -2.7439 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4567 -0.3531 -4.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3276 0.5870 -3.8067 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88 1 0 29 89 1 0 30 90 1 0 30 91 1 0 31 92 1 0 31 93 1 0 32 94 1 0 32 95 1 0 33 96 1 0 33 97 1 0 34 98 1 0 34 99 1 0 35100 1 0 35101 1 0 36102 1 0 36103 1 0 37104 1 0 37105 1 0 38106 1 0 38107 1 0 39108 1 0 39109 1 0 40110 1 0 40111 1 0 41112 1 0 41113 1 0 41114 1 0 42115 1 0 42116 1 0 46117 1 0 48118 1 0 48119 1 0 49120 1 0 49121 1 0 50122 1 0 51123 1 0 51124 1 0 51125 1 0 M END