HMDB0009091 RDKit 3D PE(18:2(9Z,12Z)/18:1(11Z)) 127126 0 0 0 0 0 0 0 0999 V2000 -1.0837 4.9540 -0.8535 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0233 5.5650 0.1295 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4826 5.3389 -0.1069 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0161 5.8803 -1.3615 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6572 5.3601 -2.6955 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0719 3.9922 -2.9389 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3564 2.9958 -3.3773 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9685 2.9884 -3.7334 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9923 2.0821 -3.2001 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0895 1.1472 -2.3194 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 0.7014 -1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8808 0.5985 -0.0822 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3138 1.8043 0.5651 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 1.5152 2.0534 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3719 2.6882 2.7406 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1495 2.4314 4.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6676 1.2620 4.5668 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0491 1.1908 4.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5882 0.0211 4.1586 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8705 2.1986 3.6852 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2003 2.0715 3.2663 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4353 1.3213 1.9982 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9685 2.1462 0.8002 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3557 1.5039 -0.3852 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9004 2.4678 -1.6967 P 0 0 0 0 0 5 0 0 0 0 0 0 4.9359 2.1556 -2.7981 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3864 2.0142 -2.2428 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0528 4.0903 -1.3330 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9532 4.8654 -1.6258 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3271 6.2948 -1.2221 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2858 7.2410 -1.4612 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8951 0.0381 2.0541 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5260 -1.1400 1.7884 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7195 -1.1325 1.4313 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8183 -2.4872 1.9132 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6180 -3.5695 1.3148 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 -4.9322 1.4919 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8573 -5.4608 1.0913 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 -4.9571 1.7258 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3865 -5.7398 1.1774 C 0 0 0 0 0 0 0 0 0 0 0 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81 1 0 17 82 1 0 21 83 1 0 21 84 1 0 22 85 1 6 23 86 1 0 23 87 1 0 27 88 1 0 29 89 1 0 29 90 1 0 30 91 1 0 30 92 1 0 31 93 1 0 31 94 1 0 35 95 1 0 35 96 1 0 36 97 1 0 36 98 1 0 37 99 1 0 37100 1 0 38101 1 0 38102 1 0 39103 1 0 39104 1 0 40105 1 0 40106 1 0 41107 1 0 41108 1 0 42109 1 0 42110 1 0 43111 1 0 43112 1 0 44113 1 0 45114 1 0 46115 1 0 46116 1 0 47117 1 0 47118 1 0 48119 1 0 48120 1 0 49121 1 0 49122 1 0 50123 1 0 50124 1 0 51125 1 0 51126 1 0 51127 1 0 M END