L85FDO -OEChem-05022322422D 36 38 0 0 0 0 0 0 0999 V2000 5.6783 0.4877 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 -0.3170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 1.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2619 -0.3170 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6783 -1.1217 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -0.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 -1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 0.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7619 -1.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7619 0.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4675 -1.7919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2646 -1.7919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 0.7656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3894 0.0754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.1970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -0.8170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9631 -1.3730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 -2.2200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0369 -1.9930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1793 -1.3951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8695 -1.7936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8695 1.1596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1793 0.7611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6542 -1.7936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3445 -1.3951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3445 0.7611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6542 1.1596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 14 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 13 2 0 0 0 0 4 14 1 0 0 0 0 4 15 1 0 0 0 0 4 16 1 0 0 0 0 5 9 1 0 0 0 0 5 14 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 7 9 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 13 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 12 2 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 15 17 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 18 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 M END $$$$