BXE71Z -OEChem-04022108062D 42 44 0 0 0 0 0 0 0999 V2000 3.6377 -0.6519 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.9358 0.0901 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7657 2.0217 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5345 1.1082 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1168 1.8126 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3644 1.0036 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9467 0.2991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4467 -1.2397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2558 -0.6519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9467 0.2991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4467 -2.2397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1114 1.7081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6991 2.5171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5290 1.0036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5807 -2.7397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3128 -2.7397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 1.1082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6937 2.4126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2924 3.4307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5807 -3.7397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3128 -3.7397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4467 -4.2397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2814 3.2216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8802 4.2397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8747 4.1352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8454 -0.8435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9404 1.1121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6686 1.4363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2823 1.6746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8646 2.3790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0438 -2.4297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8497 -2.4297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9458 1.8462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6758 3.4955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0438 -4.0497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8497 -4.0497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4467 -4.8597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8980 3.1568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6280 4.8061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2391 4.6368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1122 0.4372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 10 1 0 0 0 0 2 14 2 0 0 0 0 3 17 2 0 0 0 0 4 7 1 0 0 0 0 4 14 1 0 0 0 0 4 29 1 0 0 0 0 5 12 1 0 0 0 0 5 14 1 0 0 0 0 5 30 1 0 0 0 0 6 17 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 9 1 0 0 0 0 7 10 2 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 26 1 0 0 0 0 10 17 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 18 2 0 0 0 0 13 19 1 0 0 0 0 15 20 1 0 0 0 0 15 31 1 0 0 0 0 16 21 2 0 0 0 0 16 32 1 0 0 0 0 18 23 1 0 0 0 0 18 33 1 0 0 0 0 19 24 2 0 0 0 0 19 34 1 0 0 0 0 20 22 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 23 25 2 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 M END $$$$