B8VJ5Z -OEChem-04012112483D 23 25 0 0 0 0 0 0 0999 V2000 1.4713 -2.5062 0.0004 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2457 1.8225 0.0005 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6387 -0.2245 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7877 -0.3405 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9458 1.1364 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3107 0.9529 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6988 -1.1552 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6837 -1.4301 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2607 1.6156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6858 1.2135 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0192 -0.6911 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2936 0.6744 -0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0616 -1.1855 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5531 0.1177 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3277 2.8298 0.0006 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -2.4610 -0.0097 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4753 2.6791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0692 2.2284 -0.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8433 -1.4003 -0.0007 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3260 1.0144 -0.0012 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7549 -2.0224 -0.0028 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6269 0.2864 -0.0014 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5511 -2.6797 0.2421 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 23 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 5 2 0 0 0 0 3 7 1 0 0 0 0 4 6 1 0 0 0 0 4 8 2 0 0 0 0 5 9 1 0 0 0 0 6 10 2 0 0 0 0 7 11 2 0 0 0 0 8 13 1 0 0 0 0 8 16 1 0 0 0 0 9 12 2 0 0 0 0 9 17 1 0 0 0 0 10 14 1 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 12 20 1 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 22 1 0 0 0 0 M END $$$$