B9RV4D -OEChem-04022106172D 43 45 0 1 0 0 0 0 0999 V2000 5.9641 0.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 -0.5670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 1.9330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 3.9330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -1.0670 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8660 -1.9330 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3660 -1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 0.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 3.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 3.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 4.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2056 -0.4681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4649 -2.0935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2584 -0.4564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7834 -1.2790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7690 -0.8770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0200 1.0156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6215 0.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1762 1.8504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5747 2.5407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6215 2.5407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0200 1.8504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5747 3.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1762 4.0156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0200 4.0156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6215 3.3254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7181 4.9330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 5.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4781 4.9330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 0 0 0 5 2 1 6 0 0 0 2 9 1 0 0 0 0 2 25 1 0 0 0 0 3 12 1 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 4 15 1 0 0 0 0 4 16 1 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 1 0 0 0 6 22 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 9 12 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 17 1 0 0 0 0 10 28 1 0 0 0 0 11 18 2 0 0 0 0 11 29 1 0 0 0 0 13 15 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 16 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 19 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 M END $$$$