HMDB0008854 RDKit 3D PE(14:1(9Z)/14:0) 107106 0 0 0 0 0 0 0 0999 V2000 13.6337 1.6786 0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7763 1.9025 -0.6419 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5670 1.7375 -1.4721 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4456 2.6826 -1.2069 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8451 2.7036 0.1106 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5847 2.4295 0.4411 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6106 2.0488 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4298 2.9890 -0.6824 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6211 3.1211 0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9975 1.8669 1.0684 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0585 1.1831 0.1527 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8611 1.9214 -0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9119 2.3692 0.7786 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3864 1.2122 1.5455 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9853 0.7591 2.5516 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1983 0.6306 1.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6614 -0.4858 1.8272 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5888 -0.9851 1.2261 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.2696 -1.6029 -0.1476 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4129 -2.2980 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0 0 0 0 0 0 0 0 0 0 0 0 -9.5771 1.6907 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1030 2.8095 0.7294 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9566 3.7083 1.0591 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7514 1.0756 1.1187 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5037 1.0769 1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7293 2.6444 1.3683 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2455 2.9066 -0.8688 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5654 1.1814 -1.0038 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2467 0.6626 -1.3954 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8249 1.8442 -2.5604 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7286 2.6771 -2.0671 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9238 3.7277 -1.3373 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4660 2.9998 0.9748 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2624 2.4883 1.4913 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0535 1.8739 -1.5619 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1618 1.0304 -0.3058 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8451 2.6685 -1.5669 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8463 3.9913 -0.9216 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3383 3.4577 1.3661 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9173 3.9681 0.4493 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5813 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76 1 0 26 77 1 0 26 78 1 0 27 79 1 0 27 80 1 0 31 81 1 0 31 82 1 0 32 83 1 0 32 84 1 0 33 85 1 0 33 86 1 0 34 87 1 0 34 88 1 0 35 89 1 0 35 90 1 0 36 91 1 0 36 92 1 0 37 93 1 0 37 94 1 0 38 95 1 0 38 96 1 0 39 97 1 0 39 98 1 0 40 99 1 0 40100 1 0 41101 1 0 41102 1 0 42103 1 0 42104 1 0 43105 1 0 43106 1 0 43107 1 0 M END