HMDB0261441 RDKit 3D PE(TXB2/18:2(9Z,12Z)) 133133 0 0 0 0 0 0 0 0999 V2000 14.6576 2.8705 -1.6179 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8195 4.1359 -1.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7753 4.0905 -0.4999 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9192 2.8918 -0.7794 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8342 2.6560 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8753 3.7209 0.4173 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5954 3.6292 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7357 2.5220 -0.2026 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3092 1.2573 -0.5937 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0882 0.1357 0.0422 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2673 -0.0852 1.2118 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1246 -1.1003 1.0297 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7570 -2.3579 0.5756 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9542 -3.5755 0.4306 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7585 -3.5975 -0.4355 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9220 -3.1874 -1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 -3.4069 -2.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4983 -2.7611 -2.2044 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3743 -2.9883 -2.7873 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4348 -1.9020 -1.1499 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2118 -1.3320 -0.7389 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2840 0.1779 -0.8864 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0086 0.7481 -0.5739 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 0.5500 -1.4415 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8234 -0.0934 -2.4588 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4390 1.0657 -1.1748 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3086 1.0666 -2.3895 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6177 -0.1356 -3.1188 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4052 -1.2642 -2.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1508 -1.5498 -1.6807 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4514 -0.6996 -0.5364 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0039 -0.5130 -0.4253 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.6159 -1.8964 -0.2691 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.9363 -2.6463 0.6697 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0871 -1.7451 0.0123 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4246 -0.4212 0.6784 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5604 -0.5815 1.4502 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3555 -0.1220 1.5189 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2736 0.3734 0.7661 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.6426 1.7401 0.3195 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47 48 1 0 21 49 1 0 49 50 1 0 50 51 1 0 51 52 2 0 51 53 1 0 51 54 1 0 54 55 1 0 55 56 1 0 56 57 1 0 39 32 1 0 1 58 1 0 1 59 1 0 1 60 1 0 2 61 1 0 2 62 1 0 3 63 1 0 3 64 1 0 4 65 1 0 4 66 1 0 5 67 1 0 5 68 1 0 6 69 1 0 7 70 1 0 8 71 1 0 8 72 1 0 9 73 1 0 10 74 1 0 11 75 1 0 11 76 1 0 12 77 1 0 12 78 1 0 13 79 1 0 13 80 1 0 14 81 1 0 14 82 1 0 15 83 1 0 15 84 1 0 16 85 1 0 16 86 1 0 17 87 1 0 17 88 1 0 21 89 1 6 22 90 1 0 22 91 1 0 26 92 1 0 26 93 1 0 27 94 1 0 27 95 1 0 28 96 1 0 28 97 1 0 29 98 1 0 30 99 1 0 31100 1 0 31101 1 0 32102 1 6 33103 1 6 34104 1 0 35105 1 0 35106 1 0 36107 1 0 37108 1 0 39109 1 1 40110 1 0 41111 1 0 42112 1 1 43113 1 0 44114 1 0 44115 1 0 45116 1 0 45117 1 0 46118 1 0 46119 1 0 47120 1 0 47121 1 0 48122 1 0 48123 1 0 48124 1 0 49125 1 0 49126 1 0 53127 1 0 55128 1 0 55129 1 0 56130 1 0 56131 1 0 57132 1 0 57133 1 0 M END