HMDB0009093 RDKit 3D PE(18:2(9Z,12Z)/18:2(9Z,12Z)) 125124 0 0 0 0 0 0 0 0999 V2000 -11.5313 3.8597 -1.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9593 2.9527 -0.4906 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1595 2.1431 -0.8239 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0645 1.2401 -1.9902 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0843 0.1254 -1.9513 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6780 0.4775 -1.8026 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9128 0.0588 -0.8259 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3491 -0.8234 0.2632 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5380 -2.0661 0.2457 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8075 -2.4156 1.2707 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6835 -1.6781 2.5203 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1997 -1.2958 2.7351 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7284 -0.4553 1.5992 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2407 -0.0611 1.7475 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0594 0.7394 2.9878 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7208 1.2706 3.3092 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6668 0.2499 3.5236 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3866 -0.5229 2.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 -1.7866 2.3691 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2999 0.0204 1.0519 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0354 -0.4791 -0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7014 -1.0038 -0.5325 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3427 -2.2611 0.1883 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -2.7620 -0.4626 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3259 -4.1973 0.2622 P 0 0 0 0 0 5 0 0 0 0 0 0 0.9207 -4.1170 1.7238 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 -4.4221 0.1807 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4522 -5.4558 -0.4441 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5516 -5.4331 -1.8167 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2278 -6.5532 -2.4311 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2042 -7.8584 -2.0173 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3748 -0.0972 -0.3746 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2143 0.3386 -1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0424 -0.0891 -2.5272 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2897 1.2950 -1.0211 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5230 0.5442 -0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6402 1.4836 -0.1935 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8599 0.7183 0.2995 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3886 -0.2407 -0.7236 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5815 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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 43110 1 0 44111 1 0 44112 1 0 45113 1 0 46114 1 0 47115 1 0 47116 1 0 48117 1 0 48118 1 0 49119 1 0 49120 1 0 50121 1 0 50122 1 0 51123 1 0 51124 1 0 51125 1 0 M END