D08TRA -OEChem-04152109453D 28 28 0 0 0 0 0 0 0999 V2000 -4.9881 -1.0954 0.8223 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.2225 1.0322 0.4401 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.1597 -0.3641 -1.2182 F 0 0 0 0 0 0 0 0 0 0 0 0 1.8193 -1.2790 1.1882 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8654 -2.0718 -0.7584 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0823 0.4341 -0.2340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1583 2.5117 0.7166 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3271 0.3033 -0.1782 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1028 0.0469 -0.0685 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9056 -0.6787 0.6262 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1364 1.1571 -0.9277 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2934 -0.8069 0.6809 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5243 1.0288 -0.8728 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5869 -0.0901 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0283 -0.3387 0.4283 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4385 0.0970 0.1246 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2873 -0.7921 -0.4315 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7261 -0.5221 -0.7777 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8413 1.4280 0.4486 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3478 -1.3742 1.2369 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6985 1.9265 -1.5584 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7254 -1.5773 1.3138 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1469 1.6985 -1.4602 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4191 1.1769 -0.8431 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3736 -1.2230 -0.2404 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0559 0.4898 -0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8824 -0.6675 -1.8517 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9272 -2.1850 -0.5395 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 2 14 1 0 0 0 0 3 14 1 0 0 0 0 4 15 2 0 0 0 0 5 17 1 0 0 0 0 5 28 1 0 0 0 0 6 8 1 0 0 0 0 6 15 1 0 0 0 0 6 24 1 0 0 0 0 7 19 3 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 9 14 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 11 13 2 0 0 0 0 11 21 1 0 0 0 0 12 22 1 0 0 0 0 13 23 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 18 25 1 0 0 0 0 18 26 1 0 0 0 0 18 27 1 0 0 0 0 M END $$$$