HMDB0113032 RDKit 3D PE-NMe(15:0/22:1(13Z)) 137136 0 0 0 0 0 0 0 0999 V2000 -0.5511 -12.5603 2.2191 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5165 -11.0279 2.2934 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6928 -10.5452 1.5088 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7535 -9.0289 1.5765 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4493 -8.3665 1.0021 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3138 -6.8756 1.1211 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 -6.3061 0.4072 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9143 -4.7762 0.5607 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0098 -4.4162 1.9805 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0221 -3.7053 2.4702 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1632 -3.1779 1.7436 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3704 -1.7064 1.7855 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3132 -0.8225 1.2434 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 -0.8140 1.9581 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0369 0.0965 1.4467 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5816 -0.0531 0.1005 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 0.1725 -1.1041 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7758 1.6172 -1.1752 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5803 1.8077 -2.4034 C 0 0 0 0 0 0 0 0 0 0 0 0 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30 31 1 0 31 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 25 44 1 0 44 45 1 0 45 46 1 0 46 47 2 0 46 48 1 0 46 49 1 0 49 50 1 0 50 51 1 0 51 52 1 0 52 53 1 0 1 54 1 0 1 55 1 0 1 56 1 0 2 57 1 0 2 58 1 0 3 59 1 0 3 60 1 0 4 61 1 0 4 62 1 0 5 63 1 0 5 64 1 0 6 65 1 0 6 66 1 0 7 67 1 0 7 68 1 0 8 69 1 0 8 70 1 0 9 71 1 0 10 72 1 0 11 73 1 0 11 74 1 0 12 75 1 0 12 76 1 0 13 77 1 0 13 78 1 0 14 79 1 0 14 80 1 0 15 81 1 0 15 82 1 0 16 83 1 0 16 84 1 0 17 85 1 0 17 86 1 0 18 87 1 0 18 88 1 0 19 89 1 0 19 90 1 0 20 91 1 0 20 92 1 0 21 93 1 0 21 94 1 0 25 95 1 0 26 96 1 0 26 97 1 0 30 98 1 0 30 99 1 0 31100 1 0 31101 1 0 32102 1 0 32103 1 0 33104 1 0 33105 1 0 34106 1 0 34107 1 0 35108 1 0 35109 1 0 36110 1 0 36111 1 0 37112 1 0 37113 1 0 38114 1 0 38115 1 0 39116 1 0 39117 1 0 40118 1 0 40119 1 0 41120 1 0 41121 1 0 42122 1 0 42123 1 0 43124 1 0 43125 1 0 43126 1 0 44127 1 0 44128 1 0 48129 1 0 50130 1 0 50131 1 0 51132 1 0 51133 1 0 52134 1 0 53135 1 0 53136 1 0 53137 1 0 M END