B9PGZ8 -OEChem-04022107262D 48 50 0 0 0 0 0 0 0999 V2000 6.2619 0.1729 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 -1.5591 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 3.0849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6353 1.3901 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 0.9777 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.6318 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.6729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.3271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 0.1729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 1.9282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.1730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.8271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 -0.6931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 -0.6931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.6729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.3271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 -2.4251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 2.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 -1.5591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2619 -3.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 -2.4251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2619 -1.5591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 -0.6931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 -0.6931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2619 -3.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 3.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9684 2.5479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3751 2.0156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.7930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.4470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1793 -0.9051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8695 -1.3037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3445 -0.4810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6542 -0.0825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.9829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.6371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6793 -3.5032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3695 -3.9017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4519 -2.9621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8819 -1.5591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4519 -0.1561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0719 -0.1561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2619 -3.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8819 -3.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2619 -2.6712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3845 2.6845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8633 3.4190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1288 3.8978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 13 1 0 0 0 0 2 14 1 0 0 0 0 2 19 1 0 0 0 0 3 18 1 0 0 0 0 3 26 1 0 0 0 0 4 18 2 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 6 8 1 0 0 0 0 6 9 2 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 12 2 0 0 0 0 10 18 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 15 1 0 0 0 0 11 29 1 0 0 0 0 12 16 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 17 20 1 0 0 0 0 17 21 2 0 0 0 0 17 22 1 0 0 0 0 19 21 1 0 0 0 0 19 23 2 0 0 0 0 20 25 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 24 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M END $$$$