B1SJO6 -OEChem-04012117052D 48 50 0 0 0 0 0 0 0999 V2000 6.3981 2.4827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 1.4827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 2.4827 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 4.4827 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 -3.5173 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.0173 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.5173 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 2.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 1.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 3.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 2.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 3.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 2.4480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 4.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.9618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.0035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 4.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 -3.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 -2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -3.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -1.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -3.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 -4.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7282 -3.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -1.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0555 1.5903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 0.9001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 1.8280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 5.1373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 2.6498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 4.3156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7081 3.9457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 4.7927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0881 5.0196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5331 -1.7073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -4.1373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9951 -0.3273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -0.8973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7272 -3.3273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2422 -4.5173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 -5.1373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4822 -4.5173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0382 -3.5543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2651 -2.7073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4182 -2.4804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8612 -1.8273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 15 2 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 11 1 0 0 0 0 4 10 1 0 0 0 0 4 12 2 0 0 0 0 5 19 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 15 1 0 0 0 0 6 39 1 0 0 0 0 7 27 2 0 0 0 0 8 10 1 0 0 0 0 8 13 2 0 0 0 0 9 15 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 14 2 0 0 0 0 11 12 1 0 0 0 0 12 18 1 0 0 0 0 13 16 1 0 0 0 0 13 30 1 0 0 0 0 14 17 1 0 0 0 0 14 31 1 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 20 23 2 0 0 0 0 20 24 1 0 0 0 0 20 27 1 0 0 0 0 21 23 1 0 0 0 0 21 37 1 0 0 0 0 22 24 2 0 0 0 0 22 38 1 0 0 0 0 23 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 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 M END $$$$