B6DO2F -OEChem-04012114262D 41 44 0 0 0 0 0 0 0999 V2000 7.7619 -1.9961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 1.4067 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 -0.2640 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.2027 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2619 -1.1300 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.8007 -0.6300 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.8007 -1.6300 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 0.6020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 0.6020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 -0.2640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.1020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.1020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.6020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 -1.1300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 -1.1300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2619 -1.1300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.1020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 -0.2640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 -1.9961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 -0.2640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 -1.9961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8497 -0.3210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8497 -1.9391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8445 0.8141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 1.2126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1793 -0.4761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8695 -0.8746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 1.9961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0719 0.2729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.2220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4519 0.2729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4519 -2.5330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.4120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.2080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0719 0.2729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0719 -2.5330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6581 0.2686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6581 -2.5287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 9 1 0 0 0 0 2 11 1 0 0 0 0 2 30 1 0 0 0 0 3 10 1 0 0 0 0 3 15 1 0 0 0 0 3 31 1 0 0 0 0 4 9 2 0 0 0 0 4 12 1 0 0 0 0 5 17 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 24 2 0 0 0 0 7 25 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 16 2 0 0 0 0 13 18 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 14 20 1 0 0 0 0 16 21 1 0 0 0 0 16 33 1 0 0 0 0 17 22 2 0 0 0 0 17 23 1 0 0 0 0 18 21 2 0 0 0 0 18 36 1 0 0 0 0 19 22 1 0 0 0 0 19 34 1 0 0 0 0 20 23 2 0 0 0 0 20 35 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 M END $$$$