BSUJ28 -OEChem-04012115062D 47 50 0 1 0 0 0 0 0999 V2000 10.7899 1.5390 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 1.5110 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9531 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 0.6450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7410 1.2300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8389 1.8480 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -0.2211 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 5.0000 -1.9531 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4809 -1.0301 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0687 -0.2211 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0000 -0.2211 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5000 -1.0871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 -1.0871 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5000 0.6450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5836 0.5837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -0.2211 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.5836 -1.0258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5298 0.2789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5298 -0.7211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4809 0.5879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -0.2211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 0.6450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -1.0871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0989 2.4901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -1.0871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 0.6450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3100 0.3159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3923 -1.6977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0826 -1.2992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8100 -1.6240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0826 0.8570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3923 1.2555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8346 1.1506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0462 0.8929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6900 0.3159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0462 -1.3350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8346 -1.5927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3100 -2.4901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 -1.9531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6725 -1.6197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 -1.6240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6886 2.2985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2905 3.0797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5093 2.6816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 1.1819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -0.2211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 20 1 0 0 0 0 1 24 1 0 0 0 0 2 22 1 0 0 0 0 3 25 1 0 0 0 0 4 14 1 0 0 0 0 4 16 1 0 0 0 0 11 7 1 6 0 0 0 7 15 1 0 0 0 0 7 17 1 0 0 0 0 13 8 1 6 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 9 41 1 0 0 0 0 10 20 2 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 16 1 0 0 0 0 13 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 18 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 21 1 1 0 0 0 16 36 1 0 0 0 0 17 19 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 26 1 0 0 0 0 23 25 2 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 27 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 M END $$$$