BHRI48 -OEChem-04022110173D 40 41 0 1 0 0 0 0 0999 V2000 5.4989 2.4315 0.2020 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0500 0.7299 -0.9060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7362 -1.8343 -0.0668 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7926 -0.1524 0.6225 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7158 -0.3414 -0.4370 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0257 1.1499 -0.1871 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6636 -1.0379 0.5465 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2586 -0.7366 -0.3375 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4762 1.1285 0.2113 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2628 0.1828 -0.6674 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9112 -2.0206 0.0822 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0804 -0.1819 -0.5775 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4321 -2.3854 0.1721 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4279 -1.4658 -0.1578 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0802 1.9333 -0.1511 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5175 2.4274 -0.0705 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4249 1.4113 0.6174 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8504 1.9267 0.7344 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0058 -3.1650 0.3703 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0461 -0.5841 -1.4582 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4408 1.5627 0.6441 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8605 1.7596 -1.0812 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2453 -1.1299 1.5548 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9957 -2.0190 0.1951 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7039 -0.4213 0.9796 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5194 1.1784 -1.0178 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6661 -2.7604 0.3319 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6276 -3.3998 0.5022 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4609 2.6837 -0.6552 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6855 1.7796 0.8618 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8952 2.6102 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5425 3.3809 0.4692 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0412 1.1857 1.6192 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4404 0.4706 0.0561 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2761 2.1311 -0.2533 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4828 1.1832 1.2296 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8872 2.8493 1.3224 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0942 -3.2846 0.3852 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6539 -3.3326 1.3939 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6140 -3.9080 -0.3327 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 2 0 0 0 0 2 12 1 0 0 0 0 2 15 1 0 0 0 0 3 14 1 0 0 0 0 3 19 1 0 0 0 0 4 7 1 0 0 0 0 4 9 1 0 0 0 0 4 25 1 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 20 1 0 0 0 0 6 9 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 10 12 1 0 0 0 0 10 26 1 0 0 0 0 11 13 2 0 0 0 0 11 27 1 0 0 0 0 12 14 2 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 M END $$$$