B2IYO9 -OEChem-04022105452D 38 40 0 1 0 0 0 0 0999 V2000 5.7029 3.6691 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.3061 3.4478 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.9242 2.2723 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.9396 2.8600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4118 -1.4166 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7328 -2.9182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0528 -1.9708 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 2.0510 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3364 1.4632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7183 1.4632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0274 0.5122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0274 0.5122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1151 2.8600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7123 -0.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3518 1.6955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7029 1.6955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3424 -0.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7328 -0.0638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0547 0.9268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.9268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3219 -0.0638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3923 -1.2200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0333 -1.7742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3933 -3.6691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5365 2.2873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5182 2.2873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5408 -0.8600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3230 2.7952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1459 -0.5262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6607 1.0580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 1.0580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9088 -0.5262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1552 -2.3821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6412 -1.6523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9114 -1.1663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9278 -4.0786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8028 -4.1346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8588 -3.2596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 2 13 1 0 0 0 0 3 13 1 0 0 0 0 4 8 1 0 0 0 0 4 28 1 0 0 0 0 5 22 2 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 9 11 1 0 0 0 0 9 15 2 0 0 0 0 10 12 1 0 0 0 0 10 16 2 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 17 2 0 0 0 0 14 18 1 0 0 0 0 14 22 1 0 0 0 0 15 19 1 0 0 0 0 15 25 1 0 0 0 0 16 20 1 0 0 0 0 16 26 1 0 0 0 0 17 21 1 0 0 0 0 17 27 1 0 0 0 0 18 19 2 0 0 0 0 18 29 1 0 0 0 0 19 30 1 0 0 0 0 20 21 2 0 0 0 0 20 31 1 0 0 0 0 21 32 1 0 0 0 0 23 33 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 M END $$$$