B1EU4K -OEChem-04012113592D 44 45 0 0 0 0 0 0 0999 V2000 6.3465 2.0346 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.3465 -2.0346 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 -1.0375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7320 0.4658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -0.5208 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 -1.0241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 -0.5275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 -1.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 -1.0308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 0.5208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 1.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7282 -0.5342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4602 -0.5408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3243 -1.0442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7278 -1.4976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5249 -1.5006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3965 -0.0541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5994 -0.0510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4599 -1.5042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2569 -1.5073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7998 0.8329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8606 -0.0674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0635 -0.0644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -2.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 1.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0122 -1.5799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8601 -1.3562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6364 -0.5084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 2 18 1 0 0 0 0 3 13 2 0 0 0 0 4 19 1 0 0 0 0 4 23 1 0 0 0 0 5 20 1 0 0 0 0 5 24 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 21 2 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 14 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 1 0 0 0 0 11 17 2 0 0 0 0 12 16 1 0 0 0 0 12 18 2 0 0 0 0 14 21 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 17 19 1 0 0 0 0 17 33 1 0 0 0 0 18 20 1 0 0 0 0 19 20 2 0 0 0 0 22 25 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END $$$$