BB6OS5 -OEChem-04012114362D 47 49 0 0 0 0 0 0 0999 V2000 10.3312 -3.5670 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.5670 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.8312 -4.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8312 -2.7010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 0.2990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -1.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.5670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.0670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.5670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.4330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.0670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -3.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -3.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -3.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -4.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 3.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 4.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 -1.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -4.1870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -0.9470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -3.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.6870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8872 -4.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7341 -4.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5072 -3.5300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 1.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 2.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 4.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 5.0530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.6870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 13 1 0 0 0 0 1 23 1 0 0 0 0 2 6 2 0 0 0 0 2 7 2 0 0 0 0 2 9 1 0 0 0 0 2 12 1 0 0 0 0 5 24 2 0 0 0 0 8 15 1 0 0 0 0 8 20 2 0 0 0 0 9 21 1 0 0 0 0 9 39 1 0 0 0 0 10 21 2 0 0 0 0 10 22 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 11 40 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 18 2 0 0 0 0 14 19 1 0 0 0 0 15 22 2 0 0 0 0 16 18 1 0 0 0 0 16 31 1 0 0 0 0 17 19 2 0 0 0 0 17 32 1 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 24 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 25 26 2 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 26 41 1 0 0 0 0 27 29 2 0 0 0 0 27 42 1 0 0 0 0 28 30 2 0 0 0 0 28 43 1 0 0 0 0 29 30 1 0 0 0 0 29 44 1 0 0 0 0 30 45 1 0 0 0 0 M END $$$$