L4BH0D -OEChem-05022323192D 43 45 0 0 0 0 0 0 0999 V2000 8.1342 5.0590 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4791 -1.5288 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8080 -5.9250 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.4021 0.0590 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6342 5.9250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6342 4.1930 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2682 4.5590 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 0.0590 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 -4.9069 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4021 2.0590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5361 1.5590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2682 3.5590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4021 3.0590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2682 1.5590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5361 0.5590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1342 3.0590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1701 -2.4799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 -0.9410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1342 2.0590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8611 -1.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 -3.2889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1701 -2.4799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0002 5.5590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 -4.2024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 -3.1844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 -5.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.9934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3241 2.1416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9255 1.4513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8652 3.3690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2682 0.9390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6711 3.3690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7312 4.8690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6711 1.7490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1332 0.3690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2714 -1.3372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5345 -2.9815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3102 5.0220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5372 5.8690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6902 6.0959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6056 -4.2672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3356 -2.6180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 -3.9286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 7 1 0 0 0 0 1 23 1 0 0 0 0 2 18 1 0 0 0 0 2 22 1 0 0 0 0 3 26 1 0 0 0 0 4 15 2 0 0 0 0 7 12 1 0 0 0 0 7 33 1 0 0 0 0 8 15 1 0 0 0 0 8 18 1 0 0 0 0 8 35 1 0 0 0 0 9 26 2 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 11 15 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 30 1 0 0 0 0 14 19 2 0 0 0 0 14 31 1 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 21 1 0 0 0 0 17 22 2 0 0 0 0 18 20 2 0 0 0 0 19 34 1 0 0 0 0 20 36 1 0 0 0 0 21 24 2 0 0 0 0 21 25 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 26 1 0 0 0 0 24 41 1 0 0 0 0 25 27 2 0 0 0 0 25 42 1 0 0 0 0 27 43 1 0 0 0 0 M END $$$$