B42HES -OEChem-04022105242D 43 44 0 0 0 0 0 0 0999 V2000 3.7320 3.5950 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 3.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 3.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 6.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0950 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 2.8660 -0.9050 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 -2.4050 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 3.7320 -3.4050 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 2.0000 -5.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -6.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 2.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.7150 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 1.4631 -2.0950 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 1.4631 -3.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -4.8224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -5.5127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -6.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -7.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 -6.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 6.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 6.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 4.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 7 1 0 0 0 0 1 10 1 0 0 0 0 2 20 1 0 0 0 0 2 23 1 0 0 0 0 5 17 2 0 0 0 0 6 11 1 0 0 0 0 6 17 1 0 0 0 0 6 30 1 0 0 0 0 7 25 2 0 0 0 0 8 25 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 25 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 14 1 0 0 0 0 12 26 1 0 0 0 0 13 15 2 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 16 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 21 2 0 0 0 0 20 22 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 23 24 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 M END $$$$