B68CPT -OEChem-04012115302D 31 31 0 1 0 0 0 0 0999 V2000 2.8660 -0.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0950 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5981 2.0950 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4641 0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 0.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 2.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.5250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 11 1 0 0 0 0 2 25 1 0 0 0 0 3 12 1 0 0 0 0 3 28 1 0 0 0 0 4 11 2 0 0 0 0 5 12 2 0 0 0 0 6 13 2 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 7 22 1 0 0 0 0 10 8 1 6 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 20 1 0 0 0 0 10 12 1 0 0 0 0 10 21 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 15 26 1 0 0 0 0 16 18 2 0 0 0 0 16 27 1 0 0 0 0 17 19 2 0 0 0 0 17 29 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 M END $$$$