D09BUM -OEChem-04152110203D 38 39 0 0 0 0 0 0 0999 V2000 -3.1374 3.1893 -0.0181 S 0 0 0 0 0 0 0 0 0 0 0 0 5.8601 -1.8569 -0.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3263 0.5994 -0.3160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6767 2.2189 0.0291 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2549 1.2374 -0.0378 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6452 0.0329 -0.4914 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6036 -1.1800 -1.4269 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2737 -0.3283 0.8588 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9443 -2.3971 -0.7779 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6133 -1.5467 1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5939 -2.7436 0.5584 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0225 1.9370 -0.1089 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4699 1.6551 0.1099 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6198 0.7347 0.0686 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9142 1.2280 0.2333 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4144 -0.6297 -0.1364 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0029 0.3572 0.1927 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5031 -1.5006 -0.1769 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7974 -1.0071 -0.0125 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2793 0.7849 -0.9733 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0714 -0.9291 -2.3524 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6295 -1.4463 -1.7121 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3385 -0.5473 0.7065 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2236 0.5168 1.5546 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0214 -3.2562 -1.4543 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8741 -2.2120 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1518 -1.8125 2.4208 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5871 -1.2976 1.8006 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6213 -3.0872 0.3853 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0545 -3.5749 1.0262 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5414 -0.0439 -0.2869 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3576 3.1702 0.1841 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7034 2.7236 0.2749 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0896 2.2886 0.3937 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4174 -1.0418 -0.2677 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0089 0.7474 0.3215 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3299 -2.5613 -0.3374 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5348 -2.7612 -0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 2 19 1 0 0 0 0 2 38 1 0 0 0 0 3 6 1 0 0 0 0 3 12 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 4 32 1 0 0 0 0 5 13 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 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 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 15 34 1 0 0 0 0 16 18 2 0 0 0 0 16 35 1 0 0 0 0 17 19 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 M END $$$$