LDQ2S9 -OEChem-05022323182D 41 43 0 0 0 0 0 0 0999 V2000 6.0010 -0.0950 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 5.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -5.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.4050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.9050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.5950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -5.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 4.4050 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 6.8671 2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 2.9050 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 4.2690 -0.0950 0.0000 C 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 2.5369 -2.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -3.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 4.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -4.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.7850 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 8.2700 2.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 -1.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9091 3.8681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 4.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2891 4.9419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 -3.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 5.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -5.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 8 1 0 0 0 0 2 13 1 0 0 0 0 2 39 1 0 0 0 0 3 19 2 0 0 0 0 4 26 2 0 0 0 0 5 10 1 0 0 0 0 5 17 1 0 0 0 0 5 29 1 0 0 0 0 6 14 1 0 0 0 0 6 18 1 0 0 0 0 6 31 1 0 0 0 0 7 17 2 0 0 0 0 8 18 2 0 0 0 0 9 26 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 12 2 0 0 0 0 10 15 1 0 0 0 0 11 13 2 0 0 0 0 11 16 1 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 14 20 2 0 0 0 0 14 21 1 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 30 1 0 0 0 0 17 19 1 0 0 0 0 18 19 1 0 0 0 0 20 24 1 0 0 0 0 20 32 1 0 0 0 0 21 25 2 0 0 0 0 21 33 1 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 22 26 1 0 0 0 0 23 34 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 25 38 1 0 0 0 0 M END $$$$