HMDB0011270 RDKit 3D PC(P-18:1(11Z)/14:1(9Z)) 125124 0 0 0 0 0 0 0 0999 V2000 1.2213 -6.3043 -2.5687 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9478 -5.1361 -1.9406 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4593 -5.4408 -0.5464 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2113 -5.7910 0.2943 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5722 -6.0877 1.6684 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1212 -5.4112 2.6758 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2095 -4.2905 2.5765 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0689 -4.4652 3.3538 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 -5.5636 3.0403 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6617 -5.7482 1.7758 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6610 -4.7641 1.3324 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2749 -3.3882 0.9823 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3676 -3.2935 -0.2239 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0021 -1.8837 -0.5093 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8568 -1.4350 -0.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8316 -0.9873 -1.1246 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5066 0.3671 -1.4213 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.3906 1.1549 -0.4318 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3322 2.4562 -0.3882 O 0 0 0 0 0 0 0 0 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0 0 0 0 0 0 0 0 0 0 0 2.1387 3.1419 -8.3194 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9169 3.7882 -6.8188 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 2 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 17 38 1 0 38 39 1 0 39 40 1 0 40 41 2 0 40 42 1 0 40 43 1 0 43 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 46 48 1 0 46 49 1 0 1 50 1 0 1 51 1 0 1 52 1 0 2 53 1 0 2 54 1 0 3 55 1 0 3 56 1 0 4 57 1 0 4 58 1 0 5 59 1 0 6 60 1 0 7 61 1 0 7 62 1 0 8 63 1 0 8 64 1 0 9 65 1 0 9 66 1 0 10 67 1 0 10 68 1 0 11 69 1 0 11 70 1 0 12 71 1 0 12 72 1 0 13 73 1 0 13 74 1 0 17 75 1 1 18 76 1 0 18 77 1 0 20 78 1 0 21 79 1 0 22 80 1 0 22 81 1 0 23 82 1 0 23 83 1 0 24 84 1 0 24 85 1 0 25 86 1 0 25 87 1 0 26 88 1 0 26 89 1 0 27 90 1 0 27 91 1 0 28 92 1 0 28 93 1 0 29 94 1 0 29 95 1 0 30 96 1 0 31 97 1 0 32 98 1 0 32 99 1 0 33100 1 0 33101 1 0 34102 1 0 34103 1 0 35104 1 0 35105 1 0 36106 1 0 36107 1 0 37108 1 0 37109 1 0 37110 1 0 38111 1 0 38112 1 0 44113 1 0 44114 1 0 45115 1 0 45116 1 0 47117 1 0 47118 1 0 47119 1 0 48120 1 0 48121 1 0 48122 1 0 49123 1 0 49124 1 0 49125 1 0 M CHG 2 42 -1 46 1 M END