BS1DR7 -OEChem-04012118042D 42 44 0 0 0 0 0 0 0999 V2000 3.0000 -2.0950 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -2.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 3.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 3.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 5.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 6.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 1.9050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 3.4050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 4.9050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -6.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -3.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -3.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -3.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -4.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -4.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -5.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 4.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 5.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0781 1.8224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4766 2.5127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -0.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -0.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4631 2.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 0.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 0.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -3.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -3.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -4.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -4.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 5.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4631 -6.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5369 -6.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 12 1 0 0 0 0 1 14 1 0 0 0 0 4 22 2 0 0 0 0 5 23 2 0 0 0 0 6 27 2 0 0 0 0 7 28 2 0 0 0 0 8 13 1 0 0 0 0 8 15 1 0 0 0 0 8 33 1 0 0 0 0 9 15 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 23 1 0 0 0 0 10 28 1 0 0 0 0 10 40 1 0 0 0 0 11 26 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 16 2 0 0 0 0 12 17 1 0 0 0 0 13 18 2 0 0 0 0 13 19 1 0 0 0 0 14 20 2 0 0 0 0 14 21 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 18 1 0 0 0 0 16 31 1 0 0 0 0 17 19 2 0 0 0 0 17 32 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 20 24 1 0 0 0 0 20 36 1 0 0 0 0 21 25 2 0 0 0 0 21 37 1 0 0 0 0 22 27 1 0 0 0 0 24 26 2 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 27 28 1 0 0 0 0 M END $$$$