B6UXR5 -OEChem-04022106483D 28 28 0 0 0 0 0 0 0999 V2000 -0.5423 3.3714 -0.0002 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3089 -2.3420 0.0002 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7861 -0.6267 -0.0002 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3791 -0.6072 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9739 0.0418 0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5502 -1.4856 -1.2585 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5541 -1.4796 1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5287 0.4244 -0.0042 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1659 -0.7623 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8475 1.4310 0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -0.1773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4188 2.0160 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5586 1.2117 -0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6208 -1.0155 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4031 -0.8982 -2.1724 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5541 -1.9241 -1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8366 -2.3164 -1.2833 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5576 -1.9189 1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4109 -0.8875 2.1737 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8395 -2.3092 1.2934 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5039 -0.0780 -0.0054 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5022 1.0623 -0.8954 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5061 1.0653 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0469 -1.8415 0.0006 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7027 2.0978 0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5429 1.6741 -0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4872 3.6025 -0.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1121 -2.9053 0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 27 1 0 0 0 0 2 14 1 0 0 0 0 2 28 1 0 0 0 0 3 14 2 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 5 9 1 0 0 0 0 5 10 2 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 11 2 0 0 0 0 9 24 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 13 26 1 0 0 0 0 M END $$$$