BH21MR -OEChem-04022106593D 39 41 0 0 0 0 0 0 0999 V2000 2.0201 -1.7539 -0.6583 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8058 0.2468 -0.8985 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3456 -1.2250 0.5999 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6622 2.7520 -0.5542 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8167 0.4742 -0.1634 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1059 -0.8482 0.2337 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4891 -0.1120 -0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5111 0.8329 -0.5392 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8641 1.4052 -0.1695 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 -1.7726 0.2397 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7668 -1.4162 -0.1341 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1639 0.2300 -1.4116 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3286 -0.2959 0.5801 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1427 1.0198 0.2073 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9529 -0.5630 -0.9459 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2815 0.2649 -0.4023 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6872 -0.7557 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3182 1.2823 0.5405 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2575 -0.7209 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3530 1.3146 1.4754 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2923 -0.6885 0.5049 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3399 0.3293 1.4576 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2606 1.8433 -0.8492 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2581 -2.8006 0.5414 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0346 -2.2104 -0.0936 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8935 1.2562 -1.6886 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 -0.2327 -2.3437 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9154 1.2223 -1.1665 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9683 1.7245 0.2095 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6790 -1.8175 1.2596 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0323 -0.1910 1.8639 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4000 -0.6199 0.1724 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5528 2.0529 0.5637 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2287 -1.5190 -1.1665 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7607 3.1029 -0.8389 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4479 3.3899 -0.5431 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3897 2.1066 2.2176 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0606 -1.4560 0.4915 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1454 0.3542 2.1857 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 7 1 0 0 0 0 2 15 1 0 0 0 0 2 28 1 0 0 0 0 3 6 2 0 0 0 0 3 13 1 0 0 0 0 4 9 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 9 2 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 23 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 25 1 0 0 0 0 12 15 1 0 0 0 0 12 16 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 29 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 20 1 0 0 0 0 18 33 1 0 0 0 0 19 21 2 0 0 0 0 19 34 1 0 0 0 0 20 22 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 M END $$$$