B3OX0H -OEChem-04012116572D 45 48 0 0 0 0 0 0 0999 V2000 9.0327 -3.8995 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.9050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 3.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 4.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.9050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8418 -2.4983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 -3.2414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0109 -4.1074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -1.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -1.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 0.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 1.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 1.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -4.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9706 -1.8918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -2.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1275 -3.1766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2631 -4.6738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 3.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 4.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 4.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 28 1 0 0 0 0 2 26 2 0 0 0 0 3 9 2 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 43 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 6 29 3 0 0 0 0 7 8 1 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 8 14 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 16 1 0 0 0 0 13 20 2 0 0 0 0 13 21 1 0 0 0 0 14 18 1 0 0 0 0 14 32 1 0 0 0 0 15 19 2 0 0 0 0 15 33 1 0 0 0 0 16 22 2 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 17 26 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 20 23 1 0 0 0 0 20 36 1 0 0 0 0 21 24 2 0 0 0 0 21 37 1 0 0 0 0 22 27 1 0 0 0 0 22 38 1 0 0 0 0 23 25 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 29 1 0 0 0 0 27 28 2 0 0 0 0 27 41 1 0 0 0 0 28 42 1 0 0 0 0 M END $$$$