HMDB0011308 RDKit 3D PC(P-18:1(9Z)/18:1(11Z)) 137136 0 0 0 0 0 0 0 0999 V2000 -3.2140 -0.7904 8.4113 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4243 -1.7252 7.2568 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2299 -2.6495 7.1363 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4136 -3.6120 5.9686 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1843 -4.4897 5.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2645 -5.4941 4.7846 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3629 -4.8934 3.4709 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 -5.0490 2.4661 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6512 -5.8938 2.5629 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9352 -5.1320 2.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1231 -4.0055 3.2726 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4206 -3.2648 3.0164 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4838 -2.6699 1.6384 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3987 -1.6440 1.3984 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5388 -1.1406 -0.0307 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5242 -0.0683 -0.3392 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1521 -0.6015 -0.1323 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8677 0.4807 -0.4139 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5665 1.5813 -0.9080 O 0 0 0 0 0 0 0 0 0 0 0 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0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 2 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 21 42 1 0 42 43 1 0 43 44 1 0 44 45 2 0 44 46 1 0 44 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 50 52 1 0 50 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 8 68 1 0 9 69 1 0 9 70 1 0 10 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 21 87 1 6 22 88 1 0 22 89 1 0 24 90 1 0 25 91 1 0 26 92 1 0 26 93 1 0 27 94 1 0 27 95 1 0 28 96 1 0 28 97 1 0 29 98 1 0 29 99 1 0 30100 1 0 30101 1 0 31102 1 0 31103 1 0 32104 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 41122 1 0 42123 1 0 42124 1 0 48125 1 0 48126 1 0 49127 1 0 49128 1 0 51129 1 0 51130 1 0 51131 1 0 52132 1 0 52133 1 0 52134 1 0 53135 1 0 53136 1 0 53137 1 0 M CHG 2 46 -1 50 1 M END