BS8PG9 -OEChem-04022116393D 40 41 0 0 0 0 0 0 0999 V2000 -4.3758 -1.4066 0.2247 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8393 -1.2589 -0.2121 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4133 0.8892 -0.5917 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1866 -0.6367 0.3931 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0382 1.0330 -0.3569 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9871 0.8398 -0.4292 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5796 -1.9669 0.4199 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3345 0.4707 0.8503 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3082 -1.9932 -0.4191 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1385 0.2833 0.5779 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6344 -0.8923 -0.0123 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5446 -0.5050 0.0934 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2180 1.1166 -1.7211 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4914 0.7913 -0.7009 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6702 1.9046 0.6219 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 -1.0157 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0325 1.3047 0.9306 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8851 0.0086 0.0853 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3987 1.1668 0.6862 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3091 -0.1332 -0.1728 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2849 -2.7166 0.0456 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3662 -2.2068 1.4689 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5381 1.3957 0.3373 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4849 0.5774 1.9301 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1742 -2.9706 -0.3044 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5559 -1.8587 -1.4792 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5161 2.0827 -2.1457 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1306 1.1330 -1.6234 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4440 0.3505 -2.4736 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7462 0.0172 -1.4346 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0615 0.5817 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8491 1.7470 -1.1016 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4546 1.5169 1.6219 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5670 2.5214 0.7835 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9362 2.6535 0.3056 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3793 -1.9194 -0.7448 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6663 2.2140 1.4011 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0515 1.9759 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6932 1.9845 -0.3104 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4339 0.9984 -1.5575 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 20 2 0 0 0 0 3 5 1 0 0 0 0 3 40 1 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 12 1 0 0 0 0 5 20 1 0 0 0 0 5 39 1 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 6 14 1 0 0 0 0 6 15 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 11 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 2 0 0 0 0 10 17 1 0 0 0 0 11 16 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 18 2 0 0 0 0 16 36 1 0 0 0 0 17 19 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 38 1 0 0 0 0 M END $$$$