BS5B0K -OEChem-04022102162D 42 44 0 0 0 0 0 0 0999 V2000 5.6804 -0.6985 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.6804 0.3015 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.6804 -0.6985 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.2785 -4.1985 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.9124 -4.5645 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.9124 -2.8325 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.0448 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 0.8015 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2733 1.3893 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 4.0629 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8144 -2.1985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9483 -1.6985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -0.1985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6804 -1.6985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9483 -0.6985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8144 -3.1985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8913 1.3893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -2.1985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5464 -2.1985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5464 -3.1985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2163 -0.6985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6804 -3.6985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2163 -1.6985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6804 -0.6985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5823 2.3404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 2.3404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8424 1.0803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4124 -3.6985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 3.1494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4853 -0.3885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2774 -3.5085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0823 -2.8185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0833 -1.8885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6794 -0.3885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6804 -4.3185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6794 -2.0085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9467 2.8420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6508 0.4906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4320 0.8887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0340 1.6699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0368 4.5645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0179 4.1277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 24 1 0 0 0 0 3 24 1 0 0 0 0 4 28 1 0 0 0 0 5 28 1 0 0 0 0 6 28 1 0 0 0 0 7 29 2 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 17 1 0 0 0 0 9 26 2 0 0 0 0 10 29 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 11 16 1 0 0 0 0 12 15 2 0 0 0 0 12 18 1 0 0 0 0 13 15 1 0 0 0 0 13 21 2 0 0 0 0 14 19 1 0 0 0 0 14 24 1 0 0 0 0 15 30 1 0 0 0 0 16 22 2 0 0 0 0 16 31 1 0 0 0 0 17 25 2 0 0 0 0 17 27 1 0 0 0 0 18 23 2 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 19 33 1 0 0 0 0 20 22 1 0 0 0 0 20 28 1 0 0 0 0 21 23 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 23 36 1 0 0 0 0 25 26 1 0 0 0 0 25 37 1 0 0 0 0 26 29 1 0 0 0 0 27 38 1 0 0 0 0 27 39 1 0 0 0 0 27 40 1 0 0 0 0 M END $$$$