B4FW2D -OEChem-04022102182D 60 61 0 1 0 0 0 0 0999 V2000 5.4641 -2.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.0600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 3.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.5600 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3301 0.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -3.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -4.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0622 -3.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0622 -3.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 3.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -0.4523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -1.1426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 1.4150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 1.4150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 -1.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 -1.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 0.3323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 1.0226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 1.4769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.4031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1181 1.0226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 0.3323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 2.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4422 -4.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -5.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6822 -4.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0622 -4.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6822 -3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0622 -2.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0622 -2.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4422 -3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0622 -4.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 0.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 2.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 4.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 3.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 4.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 18 1 0 0 0 0 2 19 1 0 0 0 0 3 18 2 0 0 0 0 4 11 1 0 0 0 0 4 12 1 0 0 0 0 4 14 1 0 0 0 0 5 15 1 0 0 0 0 5 18 1 0 0 0 0 5 44 1 0 0 0 0 6 28 1 0 0 0 0 6 58 1 0 0 0 0 6 59 1 0 0 0 0 7 28 2 0 0 0 0 7 60 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 8 29 1 0 0 0 0 9 11 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 32 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 20 2 0 0 0 0 17 21 1 0 0 0 0 19 23 1 0 0 0 0 19 24 1 0 0 0 0 19 25 1 0 0 0 0 20 22 1 0 0 0 0 20 45 1 0 0 0 0 21 26 2 0 0 0 0 21 46 1 0 0 0 0 22 27 2 0 0 0 0 22 28 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 57 1 0 0 0 0 M END $$$$