B6AS1J -OEChem-04022103273D 31 33 0 1 0 0 0 0 0999 V2000 -0.6492 1.4103 0.1272 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9446 1.0431 -0.2521 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0712 -1.2446 -0.8815 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4897 -0.8693 -0.4084 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0572 -2.6815 -0.3534 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7346 -1.6604 0.8894 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5569 -2.6161 1.0362 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0157 -0.3029 -0.3954 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7208 0.6129 -0.1814 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6853 0.9820 0.0713 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3708 -0.6642 -0.4853 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7058 1.8490 0.4946 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3758 0.2084 -0.0671 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0429 1.4627 0.4301 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0864 2.4706 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0319 -1.2379 -1.9783 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2136 -1.2146 -1.1599 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -3.0778 -0.3267 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5389 -3.3562 -0.9816 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6693 -2.2271 0.8006 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8299 -1.0232 1.7756 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8678 -3.6009 1.3977 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1668 -2.2106 1.7529 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7722 2.3826 0.3852 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6622 -1.6286 -0.8924 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4623 2.8399 0.8719 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4175 -0.0908 -0.1361 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8227 2.1444 0.7564 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5239 3.0684 -0.7499 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8205 2.7531 1.0006 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1405 2.7380 -0.1556 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 1 24 1 0 0 0 0 2 9 2 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 8 1 0 0 0 0 3 16 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 4 17 1 0 0 0 0 5 7 1 0 0 0 0 5 18 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 10 1 0 0 0 0 8 11 2 0 0 0 0 10 12 2 0 0 0 0 11 13 1 0 0 0 0 11 25 1 0 0 0 0 12 14 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 M END $$$$