B8XOH7 -OEChem-04012117592D 49 50 0 0 0 0 0 0 0999 V2000 3.7320 -3.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 6.7500 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 8.9282 5.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 5.7500 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.4641 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -6.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 0.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 1.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 2.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 2.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -4.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -5.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 1.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0781 -6.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4766 -6.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -5.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -4.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -6.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -7.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -7.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 3.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 3.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 5.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 6.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 22 1 0 0 0 0 2 14 2 0 0 0 0 3 22 2 0 0 0 0 4 7 1 0 0 0 0 5 7 2 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 6 34 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 14 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 17 2 0 0 0 0 11 18 1 0 0 0 0 12 21 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 15 1 0 0 0 0 15 23 2 0 0 0 0 15 24 1 0 0 0 0 16 19 2 0 0 0 0 16 20 1 0 0 0 0 16 22 1 0 0 0 0 17 19 1 0 0 0 0 17 39 1 0 0 0 0 18 20 2 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 23 25 1 0 0 0 0 23 46 1 0 0 0 0 24 26 2 0 0 0 0 24 47 1 0 0 0 0 25 27 2 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 M CHG 2 4 -1 7 1 M END $$$$