HMDB0008137 RDKit 3D PC(18:2(9Z,12Z)/18:1(9Z)) 136135 0 0 0 0 0 0 0 0999 V2000 -6.2532 1.1966 -7.8201 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0890 1.7035 -9.1999 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7799 1.5642 -9.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5895 2.2261 -9.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1446 1.8022 -7.9359 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9372 2.5438 -7.4955 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9201 3.2961 -6.4459 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0911 3.5096 -5.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4536 4.9456 -5.4848 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4743 5.6147 -4.3818 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1308 5.0076 -3.0557 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2869 5.0738 -2.1222 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1910 4.4505 -0.8037 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2659 4.8445 0.2556 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8245 4.7465 -0.0447 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 5.0553 1.2227 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4822 4.9697 0.9136 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8786 3.6701 0.3894 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1172 3.5335 -0.8510 O 0 0 0 0 0 0 0 0 0 0 0 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0 36 37 2 0 36 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 1 0 44 45 1 0 45 46 2 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 52 53 1 0 53 54 1 0 1 55 1 0 1 56 1 0 1 57 1 0 2 58 1 0 2 59 1 0 3 60 1 0 3 61 1 0 4 62 1 0 4 63 1 0 5 64 1 0 5 65 1 0 6 66 1 0 7 67 1 0 8 68 1 0 8 69 1 0 9 70 1 0 10 71 1 0 11 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 21 86 1 0 21 87 1 0 22 88 1 1 23 89 1 0 23 90 1 0 29 91 1 0 29 92 1 0 30 93 1 0 30 94 1 0 32 95 1 0 32 96 1 0 32 97 1 0 33 98 1 0 33 99 1 0 33100 1 0 34101 1 0 34102 1 0 34103 1 0 38104 1 0 38105 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 46119 1 0 47120 1 0 47121 1 0 48122 1 0 48123 1 0 49124 1 0 49125 1 0 50126 1 0 50127 1 0 51128 1 0 51129 1 0 52130 1 0 52131 1 0 53132 1 0 53133 1 0 54134 1 0 54135 1 0 54136 1 0 M CHG 2 27 -1 31 1 M END