BD2UB8 -OEChem-04012117372D 43 44 0 0 0 0 0 0 0999 V2000 3.7320 -3.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.0600 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 3.7320 -0.4400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.4400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -3.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -1.3323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -2.0226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0841 -0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8441 -0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8862 -3.9769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -3.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5062 -2.9031 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 1.4631 2.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 1.0231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 2.0969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2181 4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9781 4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 16 1 0 0 0 0 2 22 1 0 0 0 0 3 19 1 0 0 0 0 3 23 1 0 0 0 0 4 15 2 0 0 0 0 5 8 1 0 0 0 0 5 15 1 0 0 0 0 5 27 1 0 0 0 0 6 10 1 0 0 0 0 6 12 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 17 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 14 18 1 0 0 0 0 16 19 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 20 2 0 0 0 0 18 35 1 0 0 0 0 19 21 2 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 22 38 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 23 42 1 0 0 0 0 23 43 1 0 0 0 0 M END $$$$