B1BN9M -OEChem-04022112493D 28 27 0 1 0 0 0 0 0999 V2000 2.3417 1.8756 0.4066 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2737 -0.9136 -1.6329 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0407 -0.8361 1.8582 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8113 1.7274 0.1794 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9639 1.3339 -0.4193 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1752 -0.7912 0.4661 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3553 -2.6346 0.4142 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2456 -1.1862 0.2166 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3933 -0.7014 -0.6887 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3391 0.7874 -1.0485 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1331 -0.9569 -0.4079 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 -0.5494 0.0556 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8607 0.9164 -0.0894 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1257 1.9285 0.6899 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3113 -0.6970 1.1926 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3555 -0.9269 -0.2106 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3856 -1.2683 -1.6298 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1799 1.0463 -1.7012 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4317 1.0094 -1.6179 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6588 -2.9396 1.0936 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2632 -2.8552 0.8218 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2186 -0.9926 0.7929 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7030 -1.0137 -0.9227 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3318 2.5713 1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6408 2.3434 -0.1805 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5128 0.9301 0.9074 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9529 0.1113 2.0593 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0436 2.6750 0.0775 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 14 1 0 0 0 0 2 11 2 0 0 0 0 3 6 1 0 0 0 0 3 27 1 0 0 0 0 4 13 1 0 0 0 0 4 28 1 0 0 0 0 5 13 2 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 9 17 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 M END $$$$