BC2S1J -OEChem-04022109392D 49 52 0 1 0 0 0 0 0999 V2000 10.5109 -2.1012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -2.1012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 0.8988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 2.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 1.8933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 0.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6448 -0.6012 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6448 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 0.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3769 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5109 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3769 -0.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -0.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 0.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2708 0.9334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2708 -1.1359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -0.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 -0.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1769 0.4196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1769 -0.6220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6916 2.6909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9336 2.3534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4984 1.5996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5851 0.7744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0982 1.8933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 2.5099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1675 0.1276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9791 -0.0449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1079 -0.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4328 0.9814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0343 0.2911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9094 1.3737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1124 1.3737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 -0.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 1.5188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2637 1.5534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2637 -1.7558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 0.0188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -1.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7177 0.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7127 0.7317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -1.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7127 -0.9341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 15 2 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 7 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 15 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 12 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 16 2 0 0 0 0 11 17 1 0 0 0 0 12 14 1 0 0 0 0 12 18 2 0 0 0 0 13 14 1 0 0 0 0 14 19 2 0 0 0 0 15 23 1 0 0 0 0 16 21 1 0 0 0 0 16 40 1 0 0 0 0 17 22 2 0 0 0 0 17 41 1 0 0 0 0 18 24 1 0 0 0 0 18 42 1 0 0 0 0 19 26 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 23 25 2 0 0 0 0 23 44 1 0 0 0 0 24 26 2 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 M END $$$$