HMDB0011414 RDKit 3D PE(P-18:1(11Z)/20:1(11Z)) 134133 0 0 0 0 0 0 0 0999 V2000 -13.1102 2.0330 1.7009 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1589 0.5223 1.7609 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9906 -0.0588 0.3959 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6287 0.3975 -0.1467 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4737 -0.1872 -1.5116 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1159 0.2610 -2.0771 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0747 -0.2137 -1.1928 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1953 0.5641 -0.5557 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2081 2.0051 -0.6997 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4596 2.8129 0.5046 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5673 2.8807 1.6554 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2824 1.6382 2.4244 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3689 1.9163 3.6018 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9978 2.3830 3.3219 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0143 1.4935 2.7003 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1513 0.8926 1.3766 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2675 1.7564 0.2156 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3935 1.7130 -0.7781 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3419 0.8321 -0.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3588 0.8012 -1.7473 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3538 -0.2503 -1.4517 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.9487 -1.6425 -1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8119 -1.7796 -0.3062 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4943 -3.2956 -0.1921 P 0 0 0 0 0 5 0 0 0 0 0 0 -1.9909 -4.0734 1.0033 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1915 -3.1041 -0.1015 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 -4.2389 -1.5577 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1738 -5.1761 -1.3083 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9742 -5.9663 -2.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2342 -6.6087 -2.9258 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3436 -0.0750 -0.2346 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7383 0.0194 -0.1928 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3431 -0.0536 -1.2853 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4709 0.1976 1.1075 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8910 -1.1844 1.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7898 -1.8593 0.5516 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0237 -1.0265 0.3784 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0182 -1.5660 -0.5946 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1895 -0.5826 -0.6015 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2698 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0 40 41 1 0 41 42 1 0 42 43 1 0 43 44 2 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 1 53 1 0 1 54 1 0 1 55 1 0 2 56 1 0 2 57 1 0 3 58 1 0 3 59 1 0 4 60 1 0 4 61 1 0 5 62 1 0 5 63 1 0 6 64 1 0 6 65 1 0 7 66 1 0 8 67 1 0 9 68 1 0 9 69 1 0 10 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 18 85 1 0 20 86 1 0 20 87 1 0 21 88 1 6 22 89 1 0 22 90 1 0 26 91 1 0 28 92 1 0 28 93 1 0 29 94 1 0 29 95 1 0 30 96 1 0 30 97 1 0 34 98 1 0 34 99 1 0 35100 1 0 35101 1 0 36102 1 0 36103 1 0 37104 1 0 37105 1 0 38106 1 0 38107 1 0 39108 1 0 39109 1 0 40110 1 0 40111 1 0 41112 1 0 41113 1 0 42114 1 0 42115 1 0 43116 1 0 44117 1 0 45118 1 0 45119 1 0 46120 1 0 46121 1 0 47122 1 0 47123 1 0 48124 1 0 48125 1 0 49126 1 0 49127 1 0 50128 1 0 50129 1 0 51130 1 0 51131 1 0 52132 1 0 52133 1 0 52134 1 0 M END