BWN25K -OEChem-04012117242D 40 42 0 0 0 0 0 0 0999 V2000 7.2622 0.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 2.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 2.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 -1.3100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 -1.3447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 -0.8308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 0.7247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 0.2108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7817 -2.3446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.3342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 -2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 -2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7773 1.3446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3284 0.5229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1618 -2.3518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7889 -2.9646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4017 -2.3374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6879 -0.7984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -1.6462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3121 -1.8699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 -0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7252 -2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5312 -1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 -3.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5502 -3.3469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3972 -3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1703 -2.2731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 36 1 0 0 0 0 2 19 1 0 0 0 0 2 40 1 0 0 0 0 3 19 2 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 8 2 0 0 0 0 6 12 1 0 0 0 0 7 9 2 0 0 0 0 7 15 1 0 0 0 0 8 11 1 0 0 0 0 8 19 1 0 0 0 0 9 13 1 0 0 0 0 9 16 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 21 1 0 0 0 0 17 32 1 0 0 0 0 18 22 2 0 0 0 0 18 33 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M END $$$$