BL9P4R -OEChem-04022106482D 39 40 0 1 0 0 0 0 0999 V2000 4.2690 0.0950 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 0.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2690 0.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 3.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 4.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.0950 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 2.5369 3.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -4.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7924 1.7027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1909 1.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -1.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -2.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 1.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 2.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0930 -3.8681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 -4.9419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.4050 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 7 1 0 0 0 0 1 9 1 0 0 0 0 4 19 1 0 0 0 0 4 23 1 0 0 0 0 5 16 2 0 0 0 0 6 8 1 0 0 0 0 6 39 1 0 0 0 0 7 10 1 0 0 0 0 7 11 1 0 0 0 0 8 16 1 0 0 0 0 8 35 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 10 16 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 17 1 0 0 0 0 12 26 1 0 0 0 0 13 18 2 0 0 0 0 13 27 1 0 0 0 0 14 20 1 0 0 0 0 14 28 1 0 0 0 0 15 21 2 0 0 0 0 15 29 1 0 0 0 0 17 19 2 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 20 22 2 0 0 0 0 20 32 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 M END $$$$