B6M4IT -OEChem-04022106482D 41 43 0 0 0 0 0 0 0999 V2000 4.2601 3.3844 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.8381 -0.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.1244 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 1.8456 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5202 2.1244 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7281 1.1462 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 0.8456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 2.4334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 3.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5691 2.4334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 0.3456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 0.3456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -0.6544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -0.6544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -1.1544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6791 0.8372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8870 -0.1410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0460 -1.4281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4223 1.5063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9970 -1.7371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3028 -2.0973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2050 -2.7153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5108 -3.0754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4618 -3.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3249 4.0010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6536 3.5133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 0.6556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 0.6556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 -0.9644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -0.9644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -1.7744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2674 -0.1626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8007 -0.7549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8371 1.0456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8830 1.9212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0074 1.9671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4578 -1.3223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7132 -1.9057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7946 -2.9069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0500 -3.4903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5907 -3.9909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 8 2 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 16 2 0 0 0 0 7 11 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 11 13 1 0 0 0 0 11 27 1 0 0 0 0 12 14 2 0 0 0 0 12 28 1 0 0 0 0 13 15 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 22 1 0 0 0 0 20 37 1 0 0 0 0 21 23 2 0 0 0 0 21 38 1 0 0 0 0 22 24 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 M END $$$$