BFD7K3 -OEChem-04012113083D 28 30 0 0 0 0 0 0 0999 V2000 1.9772 2.1404 0.0078 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2403 -0.1818 0.0264 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4658 -1.8408 0.0072 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8199 -1.2786 -0.0136 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2984 -1.1464 0.0348 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1213 -0.5379 0.0122 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6366 -0.4612 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1188 0.4301 0.0043 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4547 0.0312 -0.0086 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2560 -0.1286 1.2108 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2375 -0.1695 -1.2046 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3438 1.1472 -0.0154 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6733 2.3489 -0.0076 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4978 0.5067 1.1907 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4791 0.4658 -1.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7802 -2.1294 -0.0052 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1093 0.8039 -0.0273 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2288 -1.7856 0.9243 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2181 -1.8147 -0.8322 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4561 0.8095 0.0338 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7876 -0.3537 2.1649 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7547 -0.4267 -2.1432 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4239 1.0727 -0.0254 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1011 3.3416 -0.0103 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9882 0.7705 2.1231 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9551 0.6978 -2.1733 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0317 -3.1842 -0.0089 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0758 1.2987 -0.0431 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 13 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 2 20 1 0 0 0 0 3 6 2 0 0 0 0 3 16 1 0 0 0 0 4 9 1 0 0 0 0 4 16 2 0 0 0 0 5 7 1 0 0 0 0 5 18 1 0 0 0 0 5 19 1 0 0 0 0 6 8 1 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 9 12 1 0 0 0 0 10 14 1 0 0 0 0 10 21 1 0 0 0 0 11 15 2 0 0 0 0 11 22 1 0 0 0 0 12 13 2 0 0 0 0 12 23 1 0 0 0 0 13 24 1 0 0 0 0 14 17 2 0 0 0 0 14 25 1 0 0 0 0 15 17 1 0 0 0 0 15 26 1 0 0 0 0 16 27 1 0 0 0 0 17 28 1 0 0 0 0 M END $$$$