BHB4Z2 -OEChem-04022106172D 58 60 0 0 0 0 0 0 0999 V2000 8.6634 2.9238 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 5.0966 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 7.0332 1.2058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2675 6.6558 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2675 8.6558 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0798 3.8511 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4015 5.1558 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0798 5.4606 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2675 3.6558 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4015 7.1558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1335 7.1558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4015 8.1558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1335 8.1558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2675 5.6558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2675 9.6558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1335 5.1558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1335 4.1558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4015 10.1558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6634 4.6558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3904 2.9006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4015 4.1558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6634 4.6558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7226 2.1563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5355 3.6558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1634 3.7898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1634 5.5219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1634 3.7898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1634 5.5219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6634 4.6558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3654 0.4615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7909 7.2635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1894 6.5732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3456 6.5732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7441 7.2635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1894 8.7384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7909 8.0482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7441 8.0482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3456 8.7384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8781 9.5482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4796 10.2385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7115 10.6928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8646 10.4658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0915 9.6189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7730 2.4127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9373 3.1926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3400 2.6442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1756 1.8643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2255 4.1928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9985 3.3458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8455 3.1189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8534 6.0588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4734 3.2529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4734 6.0588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2834 4.6558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9039 0.8755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9513 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8269 0.0474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 5.0966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 58 1 0 0 0 0 3 23 1 0 0 0 0 3 30 1 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 4 14 1 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 5 15 1 0 0 0 0 6 17 1 0 0 0 0 6 19 1 0 0 0 0 6 20 1 0 0 0 0 7 14 2 0 0 0 0 7 21 1 0 0 0 0 8 16 1 0 0 0 0 8 19 2 0 0 0 0 9 17 1 0 0 0 0 9 21 2 0 0 0 0 10 12 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 13 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 16 1 0 0 0 0 15 18 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 22 1 0 0 0 0 20 23 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 24 1 0 0 0 0 22 25 1 0 0 0 0 22 26 2 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 27 2 0 0 0 0 26 28 1 0 0 0 0 26 51 1 0 0 0 0 27 29 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 M END $$$$