B25SQA -OEChem-04022113083D 47 49 0 1 0 0 0 0 0999 V2000 -1.1027 0.7582 1.9351 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2897 -0.5284 0.1709 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1551 -1.4215 0.5224 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9623 3.2434 0.4325 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1482 -0.5590 -0.1073 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.4474 -1.2821 -0.2228 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 0.7382 0.7111 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4351 2.0318 0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2017 -1.1984 0.4357 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1152 2.2405 -1.1789 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7190 -2.0518 -1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3909 -1.1886 0.8002 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3299 4.2221 -0.4535 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0489 3.6264 -1.4661 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0932 -2.0674 1.0651 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6842 -0.1039 -0.2822 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1925 3.4721 1.6355 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9343 -2.7281 -1.4621 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6061 -1.8649 0.6922 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4670 -1.8423 0.9762 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0579 0.1213 -0.3709 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8776 -2.6349 -0.4389 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9493 -0.7478 0.2582 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7665 0.1152 -1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1799 -0.3501 -1.2887 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8317 -0.3070 -1.1274 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4756 -2.1791 1.1161 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6108 1.4864 -1.7746 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9922 -2.1351 -2.1578 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2125 -0.6137 1.7029 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0552 5.2565 -0.2957 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4784 4.1354 -2.3174 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7312 -2.9243 1.6275 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0457 0.6069 -0.7936 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8468 3.3274 2.4985 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6502 2.7764 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1883 4.4971 1.6319 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1456 -3.3280 -2.3426 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3398 -1.7955 1.4901 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1566 -2.5228 1.4679 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3910 0.9991 -0.9167 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8234 -3.1624 -0.5225 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1583 -0.1385 -1.8873 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7567 1.2001 -0.8576 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8347 -0.1227 -0.4409 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2080 -1.4357 -1.4297 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5820 0.1327 -2.1839 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 2 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 3 27 1 0 0 0 0 4 8 1 0 0 0 0 4 13 1 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 26 1 0 0 0 0 6 11 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 8 10 2 0 0 0 0 9 15 2 0 0 0 0 9 16 1 0 0 0 0 10 14 1 0 0 0 0 10 28 1 0 0 0 0 11 18 1 0 0 0 0 11 29 1 0 0 0 0 12 19 2 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 32 1 0 0 0 0 15 20 1 0 0 0 0 15 33 1 0 0 0 0 16 21 2 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 22 2 0 0 0 0 18 38 1 0 0 0 0 19 22 1 0 0 0 0 19 39 1 0 0 0 0 20 23 2 0 0 0 0 20 40 1 0 0 0 0 21 23 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 M END $$$$