BNA5K7 -OEChem-04012112392D 52 55 0 1 0 0 0 0 0999 V2000 5.2686 1.1580 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6183 2.2418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5726 3.1272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6350 1.4657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9323 -2.6957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 -0.6025 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6146 0.0662 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 -2.2120 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4072 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.9072 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.4072 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8066 0.6554 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8083 1.6554 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8550 0.3480 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8578 1.9660 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5504 2.9176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.9072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -1.4072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5288 0.4714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3368 -0.1178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.4072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.9072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2305 -1.1122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2510 0.2873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0385 -1.7014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0590 -0.3019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9528 -1.2962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7403 -3.2849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3595 0.9359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7124 2.2679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2926 -0.0911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2456 2.0641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5487 -0.5503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1645 3.0029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5731 3.5372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5546 2.8585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7479 -1.4072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3820 3.7172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6637 -1.3634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3169 0.9038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -3.7172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.7172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.1297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.0972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.9442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6259 -0.0507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4537 -1.6615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3750 -3.7858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2413 -3.6502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1056 -2.7839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 13 2 1 1 0 0 0 2 38 1 0 0 0 0 3 16 1 0 0 0 0 3 40 1 0 0 0 0 4 19 2 0 0 0 0 5 27 1 0 0 0 0 5 30 1 0 0 0 0 14 6 1 6 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 12 7 1 1 0 0 0 7 19 1 0 0 0 0 7 35 1 0 0 0 0 8 18 2 0 0 0 0 8 20 1 0 0 0 0 9 17 2 0 0 0 0 9 23 1 0 0 0 0 10 22 1 0 0 0 0 10 23 2 0 0 0 0 11 22 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 13 15 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 6 0 0 0 15 34 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 20 1 0 0 0 0 18 39 1 0 0 0 0 19 21 1 0 0 0 0 20 22 2 0 0 0 0 21 24 2 0 0 0 0 21 25 1 0 0 0 0 23 26 1 0 0 0 0 24 27 1 0 0 0 0 24 41 1 0 0 0 0 25 28 2 0 0 0 0 25 42 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 29 2 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 M END $$$$