BHEJ40 -OEChem-04022109503D 42 44 0 0 0 0 0 0 0999 V2000 4.1582 -2.9704 -0.7638 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.1477 2.9718 -0.7671 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.8603 -2.5373 1.9539 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.8507 2.5474 1.9515 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.0948 2.3354 -0.8993 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1006 -2.3374 -0.8957 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8338 3.5167 -0.4947 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9565 2.0199 -2.3081 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8431 -3.5159 -0.4894 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9615 -2.0242 -2.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5465 2.3564 -0.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5522 -2.3622 -0.1406 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7652 1.1614 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7672 -1.1696 -0.1423 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8661 0.9518 -0.1095 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8675 -0.9504 -0.1076 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3829 0.5773 -1.3517 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3833 -0.5882 -1.3507 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3812 0.5802 1.0645 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3851 -0.5853 1.0653 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7412 -0.3245 -0.6585 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7388 0.3247 -0.6583 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5996 1.1382 1.0623 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6013 -1.1330 1.0645 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -1.4142 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3442 1.4170 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2082 0.0486 1.6849 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2067 -0.0409 1.6858 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0835 -1.2276 1.1358 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0780 1.2343 1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4728 2.9217 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -2.9265 0.7161 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6477 1.0212 -2.3061 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6477 -1.0340 -2.3044 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6738 1.0261 2.0115 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6798 -1.0284 2.0131 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1776 -0.4761 -1.5753 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1747 0.4735 -1.5754 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7034 2.1218 1.5113 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7081 -2.1158 1.5148 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7746 0.2117 2.5984 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7735 -0.2010 2.5996 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 26 1 0 0 0 0 3 29 1 0 0 0 0 4 30 1 0 0 0 0 5 7 2 0 0 0 0 5 8 2 0 0 0 0 5 11 1 0 0 0 0 5 15 1 0 0 0 0 6 9 2 0 0 0 0 6 10 2 0 0 0 0 6 12 1 0 0 0 0 6 16 1 0 0 0 0 11 13 1 0 0 0 0 11 31 1 0 0 0 0 12 14 1 0 0 0 0 12 32 1 0 0 0 0 13 17 2 0 0 0 0 13 19 1 0 0 0 0 14 18 2 0 0 0 0 14 20 1 0 0 0 0 15 21 2 0 0 0 0 15 23 1 0 0 0 0 16 22 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 21 25 1 0 0 0 0 21 37 1 0 0 0 0 22 26 1 0 0 0 0 22 38 1 0 0 0 0 23 27 2 0 0 0 0 23 39 1 0 0 0 0 24 28 2 0 0 0 0 24 40 1 0 0 0 0 25 29 2 0 0 0 0 26 30 2 0 0 0 0 27 29 1 0 0 0 0 27 41 1 0 0 0 0 28 30 1 0 0 0 0 28 42 1 0 0 0 0 M END $$$$