B6TQU3 -OEChem-04022105312D 52 55 0 1 0 0 0 0 0999 V2000 10.0994 -3.3890 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.1719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.3281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.8282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1424 -2.9766 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7260 -2.1718 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.1718 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.8282 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.6718 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.3282 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.3282 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.3281 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1962 -1.6718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.6718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.1719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.1718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.3282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4530 -3.9271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1424 -1.3671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4315 -4.1333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7852 -4.6714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.1719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.6718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.8282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7422 -5.0838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0958 -5.6219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0744 -5.8282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.3281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.3282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.8282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.3282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.8282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.2919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 -0.6468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 -0.6468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3350 -0.7778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 1.5182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1785 -4.5436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4675 -0.6468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2646 -0.6468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -2.9818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3489 -5.2117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6818 -6.0834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2670 -6.4175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.8651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.6381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.2088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 3.0182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 4.6382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2181 5.8282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 6.4482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9781 5.8282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 12 2 1 1 0 0 0 2 16 1 0 0 0 0 3 15 1 0 0 0 0 3 22 1 0 0 0 0 4 17 2 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 5 18 1 0 0 0 0 6 19 2 0 0 0 0 7 14 1 0 0 0 0 7 23 2 0 0 0 0 8 17 1 0 0 0 0 8 24 1 0 0 0 0 8 37 1 0 0 0 0 9 16 2 0 0 0 0 9 23 1 0 0 0 0 10 24 2 0 0 0 0 10 31 1 0 0 0 0 11 29 2 0 0 0 0 11 30 1 0 0 0 0 12 15 1 0 0 0 0 12 17 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 13 19 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 18 20 1 0 0 0 0 18 21 2 0 0 0 0 19 36 1 0 0 0 0 20 25 2 0 0 0 0 21 26 1 0 0 0 0 21 38 1 0 0 0 0 22 28 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 24 29 1 0 0 0 0 25 27 1 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 31 49 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 M END $$$$