B5YQ2V -OEChem-04022109452D 44 46 0 0 0 0 0 0 0999 V2000 6.0010 -1.4050 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 3.0950 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 4.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0010 -1.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0010 -1.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 2.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 4.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.4050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 3.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6270 1.0603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6270 3.1297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5331 1.5742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5331 2.6158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -3.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -4.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 3.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0791 -0.4876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4776 0.2027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6199 0.4404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6199 3.7496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0688 1.2621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0688 2.9279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 -2.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 2.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 2.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 -4.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -5.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 8 1 0 0 0 0 1 18 1 0 0 0 0 2 15 1 0 0 0 0 2 23 1 0 0 0 0 3 14 1 0 0 0 0 3 38 1 0 0 0 0 6 27 1 0 0 0 0 6 44 1 0 0 0 0 7 27 2 0 0 0 0 8 11 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 2 0 0 0 0 10 12 1 0 0 0 0 10 16 2 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 14 1 0 0 0 0 12 17 2 0 0 0 0 13 15 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 16 19 1 0 0 0 0 16 32 1 0 0 0 0 17 20 1 0 0 0 0 17 33 1 0 0 0 0 18 21 2 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 21 24 1 0 0 0 0 21 36 1 0 0 0 0 22 25 2 0 0 0 0 22 37 1 0 0 0 0 23 27 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 26 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 M END $$$$