BL8KB0 -OEChem-04022106542D 58 61 0 1 0 0 0 0 0999 V2000 3.4030 -3.5173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.9827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -2.5173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.4827 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 5.1350 -2.5173 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -1.0173 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -2.5173 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 2.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 3.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 2.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4931 1.9480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 3.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 3.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4931 4.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3991 2.4618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3991 3.5035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3996 1.4576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6025 1.4576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9451 0.4001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3437 1.0903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3471 -4.0999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7456 -3.4097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 -1.5424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 -1.5424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7365 0.0077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5335 0.0077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 -4.4923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 -4.4923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1909 -1.9347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7924 -2.6250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.7073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 1.4576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 1.4576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 -0.7073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.1727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0044 0.0077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8015 0.0077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4859 1.3280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 4.6027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.7927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4859 4.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9349 2.1498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9349 3.8156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.6727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 23 1 0 0 0 0 2 58 1 0 0 0 0 3 24 2 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 5 14 1 0 0 0 0 6 10 1 0 0 0 0 6 24 1 0 0 0 0 6 48 1 0 0 0 0 7 14 2 0 0 0 0 7 24 1 0 0 0 0 8 13 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 15 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 18 2 0 0 0 0 11 16 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 17 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 19 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 18 1 0 0 0 0 15 20 1 0 0 0 0 15 22 2 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 19 23 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 26 1 0 0 0 0 21 28 2 0 0 0 0 22 27 1 0 0 0 0 22 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 25 29 1 0 0 0 0 25 52 1 0 0 0 0 26 27 2 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 28 30 1 0 0 0 0 28 55 1 0 0 0 0 29 30 2 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 M END $$$$