B1MKD6 -OEChem-04022116593D 34 34 0 0 0 0 0 0 0999 V2000 1.6182 -2.0594 -0.0349 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1605 -1.2993 0.0262 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9855 0.4403 0.0502 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4284 2.1219 -0.0549 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3512 0.4070 0.0068 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8523 0.0639 0.0015 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6985 1.2366 -1.2482 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6918 1.2287 1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2759 -0.8313 0.0055 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9483 1.0966 0.0034 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4864 -1.2587 -0.0037 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1776 -0.5470 -0.0057 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5884 0.7860 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1266 -1.5693 -0.0074 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2401 -0.8713 -0.0115 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2815 0.2572 -0.0116 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7337 -0.1548 0.0019 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7490 0.9528 0.0136 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4344 0.6955 -2.1645 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7716 1.4577 -1.2902 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1752 2.1986 -1.2717 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1686 2.1907 1.2957 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7647 1.4492 1.3184 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4224 0.6818 2.1805 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3306 -0.5288 0.0095 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1323 -1.4501 -0.8881 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1272 -1.4558 0.8944 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2450 2.1398 0.0075 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1789 -2.0905 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1133 1.6140 -0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8317 -2.6154 -0.0115 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1285 0.8543 -0.9175 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1184 0.8649 0.8855 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6771 1.1359 0.0344 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 17 2 0 0 0 0 3 18 1 0 0 0 0 3 34 1 0 0 0 0 4 18 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 6 10 2 0 0 0 0 6 11 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 13 1 0 0 0 0 10 28 1 0 0 0 0 11 14 2 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 M END $$$$