BX28NQ -OEChem-04012116432D 41 41 0 1 0 0 0 0 0999 V2000 3.0000 0.4400 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 0.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 3.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 3.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 0.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -4.0600 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.8660 -4.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 1.4400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 1.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -3.5600 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.8660 1.9400 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7320 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 1.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -1.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -1.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -2.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0622 1.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 1.3200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3335 0.9651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1306 0.9651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9966 2.4150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1996 2.4150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4631 1.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -0.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -0.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7976 0.9651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5947 0.9651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3722 1.4031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5991 2.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7522 2.4769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 9 1 0 0 0 0 1 15 1 0 0 0 0 4 16 1 0 0 0 0 4 38 1 0 0 0 0 5 16 2 0 0 0 0 6 17 2 0 0 0 0 7 11 1 0 0 0 0 8 11 2 0 0 0 0 12 9 1 6 0 0 0 9 30 1 0 0 0 0 10 17 1 0 0 0 0 10 20 1 0 0 0 0 10 33 1 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 14 17 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 18 21 1 0 0 0 0 18 31 1 0 0 0 0 19 22 2 0 0 0 0 19 32 1 0 0 0 0 20 24 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 23 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 M CHG 2 7 -1 11 1 M END $$$$