B1RJ6W -OEChem-04022109382D 43 47 0 0 0 0 0 0 0999 V2000 2.1953 -2.0017 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -0.4181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2619 3.8140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7619 4.6800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 2.5819 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6783 1.2772 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.4181 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 2.9479 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8047 -2.0017 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 1.5819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 1.0819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 2.0819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6783 2.8866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 3.0819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 1.5819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2619 2.0819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 2.5819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 0.0819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.4181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -2.9479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -2.9479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 1.2159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -3.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7619 1.2159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7619 2.9479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 2.0819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -4.6800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -4.6800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 3.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8709 3.4760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 3.7019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4631 1.2719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4631 2.8919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4631 -0.1081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4519 0.6789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -3.8140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 -3.8140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0719 0.6789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8819 2.0819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 -5.2169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 -5.2169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5719 4.3509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 18 2 0 0 0 0 3 30 1 0 0 0 0 3 43 1 0 0 0 0 4 30 2 0 0 0 0 5 10 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 6 10 2 0 0 0 0 6 12 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 7 35 1 0 0 0 0 8 16 2 0 0 0 0 8 26 1 0 0 0 0 9 19 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 11 15 2 0 0 0 0 11 18 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 31 1 0 0 0 0 14 17 2 0 0 0 0 14 32 1 0 0 0 0 15 17 1 0 0 0 0 15 33 1 0 0 0 0 16 22 1 0 0 0 0 17 34 1 0 0 0 0 20 21 1 0 0 0 0 20 23 2 0 0 0 0 21 24 2 0 0 0 0 22 25 2 0 0 0 0 22 36 1 0 0 0 0 23 28 1 0 0 0 0 23 37 1 0 0 0 0 24 29 1 0 0 0 0 24 38 1 0 0 0 0 25 27 1 0 0 0 0 25 39 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 40 1 0 0 0 0 28 29 2 0 0 0 0 28 41 1 0 0 0 0 29 42 1 0 0 0 0 M END $$$$