HMDB0011241 RDKit 3D PC(P-18:0/18:0) 141140 0 0 0 0 0 0 0 0999 V2000 2.9908 5.5802 5.9945 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8188 4.9227 4.8996 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9963 4.7531 3.6702 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7762 3.9140 3.9318 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1461 2.5581 4.3893 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9488 1.6889 4.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1354 1.4782 3.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0548 0.6105 3.6386 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0329 1.0065 4.6585 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7976 2.2659 4.5858 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0623 3.5367 4.6289 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9684 4.7550 4.6149 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8646 4.9014 3.4659 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2351 5.0094 2.1068 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3626 5.2000 1.1188 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9070 5.3500 -0.3177 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1431 5.5826 -1.1377 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5390 4.9012 -2.1527 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7949 3.8096 -2.6112 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0845 3.3137 -3.9276 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13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 24 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 30 32 1 0 30 33 1 0 21 34 1 0 34 35 1 0 35 36 2 0 35 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 43 44 1 0 44 45 1 0 45 46 1 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 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 9 72 1 0 10 73 1 0 10 74 1 0 11 75 1 0 11 76 1 0 12 77 1 0 12 78 1 0 13 79 1 0 13 80 1 0 14 81 1 0 14 82 1 0 15 83 1 0 15 84 1 0 16 85 1 0 16 86 1 0 17 87 1 0 18 88 1 0 20 89 1 0 20 90 1 0 21 91 1 6 22 92 1 0 22 93 1 0 28 94 1 0 28 95 1 0 29 96 1 0 29 97 1 0 31 98 1 0 31 99 1 0 31100 1 0 32101 1 0 32102 1 0 32103 1 0 33104 1 0 33105 1 0 33106 1 0 37107 1 0 37108 1 0 38109 1 0 38110 1 0 39111 1 0 39112 1 0 40113 1 0 40114 1 0 41115 1 0 41116 1 0 42117 1 0 42118 1 0 43119 1 0 43120 1 0 44121 1 0 44122 1 0 45123 1 0 45124 1 0 46125 1 0 46126 1 0 47127 1 0 47128 1 0 48129 1 0 48130 1 0 49131 1 0 49132 1 0 50133 1 0 50134 1 0 51135 1 0 51136 1 0 52137 1 0 52138 1 0 53139 1 0 53140 1 0 53141 1 0 M CHG 2 26 -1 30 1 M END