HMDB0113426 RDKit 3D PE-NMe(20:4(5Z,8Z,11Z,14Z)/16:1(9Z)) 126125 0 0 0 0 0 0 0 0999 V2000 -12.3996 6.7858 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6105 6.1043 0.8644 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3014 5.4624 1.2925 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8447 4.4318 0.2819 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5290 3.8209 0.7591 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6780 3.1678 2.0686 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4754 1.8978 2.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0490 0.9495 1.2406 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1035 -0.0847 1.1107 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0089 -1.3480 1.2569 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7498 -2.0447 1.6004 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4967 -3.0613 0.5845 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5001 -3.2130 -0.1717 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2768 -2.4744 -0.3233 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0051 -1.2553 0.3907 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0555 -1.0843 1.2831 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1010 -2.1039 1.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6854 -1.6139 1.3537 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6939 -1.5451 -0.1574 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3921 -1.1087 -0.7337 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5307 -0.4281 -0.1481 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1288 -1.4996 -2.0104 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1326 -1.3616 -2.8988 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2168 -1.8466 -2.3753 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9359 -3.0932 -1.6077 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0152 -3.5578 -0.8414 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5006 -4.8582 0.0828 P 0 0 0 0 0 5 0 0 0 0 0 0 -0.0428 -4.7737 0.1592 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0924 -4.7285 1.6922 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8608 -6.3614 -0.4771 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6895 -6.6381 -1.7959 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0056 -8.1127 -2.0881 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8161 -8.4024 -3.4932 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 -9.8274 -3.7297 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 -0.8349 -1.4297 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7279 -0.0790 -1.7419 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3229 -0.3266 -2.8459 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1965 0.9650 -0.8299 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3373 1.7684 -1.3897 C 0 0 0 0 0 0 0 0 0 0 0 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81 1 0 19 82 1 0 19 83 1 0 23 84 1 0 23 85 1 0 24 86 1 0 25 87 1 0 25 88 1 0 29 89 1 0 31 90 1 0 31 91 1 0 32 92 1 0 32 93 1 0 33 94 1 0 34 95 1 0 34 96 1 0 34 97 1 0 38 98 1 0 38 99 1 0 39100 1 0 39101 1 0 40102 1 0 40103 1 0 41104 1 0 41105 1 0 42106 1 0 42107 1 0 43108 1 0 43109 1 0 44110 1 0 44111 1 0 45112 1 0 46113 1 0 47114 1 0 47115 1 0 48116 1 0 48117 1 0 49118 1 0 49119 1 0 50120 1 0 50121 1 0 51122 1 0 51123 1 0 52124 1 0 52125 1 0 52126 1 0 M END