BPU8Q2 -OEChem-04022116093D 53 57 0 0 0 0 0 0 0999 V2000 5.3268 0.7957 0.4653 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.6693 1.1090 -1.1785 F 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 1.8350 0.3963 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7649 -2.5809 -0.1257 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3884 -4.2005 0.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3908 1.7961 -1.8013 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6599 1.2870 -1.5979 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2223 2.0039 0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6587 2.6696 -0.2108 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 2.6200 1.0052 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0804 -1.6364 0.0268 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0861 0.7405 1.1869 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 3.9245 -0.7279 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7564 3.8835 0.4753 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5842 -2.8801 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9312 2.1024 -0.6106 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3290 1.9544 1.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4246 -0.9630 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8692 4.5302 -0.3856 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3986 -1.8974 -1.1619 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5141 -1.9971 1.2495 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1505 -2.5191 -1.1276 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -2.6188 1.2836 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2493 -3.5444 0.1309 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 0.0936 2.0477 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0062 0.6994 2.3901 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8605 1.3289 -0.3014 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0033 -1.9473 -0.4038 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0445 -3.0459 -0.1245 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2904 -1.9921 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6171 -0.8700 -1.2014 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1914 -0.9600 -0.1298 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 0.1622 -1.4633 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8051 0.1172 -0.9275 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0027 0.2145 0.9405 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0138 4.4467 -1.3995 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6931 4.3756 0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2776 2.4080 2.1527 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1206 -1.4742 0.6643 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8600 -1.0242 -1.0138 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1201 5.5073 -0.7883 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8277 -1.6240 -2.1221 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0351 -1.7999 2.1826 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6275 -2.7165 -2.0597 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8356 -2.8913 2.2435 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -4.0090 1.1092 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2121 -4.3369 -0.6272 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5532 -0.8853 2.4477 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6978 0.1938 3.0577 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6055 -2.8225 0.7583 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6242 -0.8134 -1.6397 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1931 -0.9938 0.2881 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2176 1.0011 -2.0841 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 27 1 0 0 0 0 2 34 1 0 0 0 0 3 16 1 0 0 0 0 3 27 1 0 0 0 0 4 24 1 0 0 0 0 4 29 1 0 0 0 0 5 29 2 0 0 0 0 6 7 1 0 0 0 0 6 16 2 0 0 0 0 7 27 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 2 0 0 0 0 9 13 2 0 0 0 0 9 16 1 0 0 0 0 10 14 1 0 0 0 0 10 17 2 0 0 0 0 11 18 1 0 0 0 0 11 20 2 0 0 0 0 11 21 1 0 0 0 0 12 25 1 0 0 0 0 12 35 1 0 0 0 0 13 19 1 0 0 0 0 13 36 1 0 0 0 0 14 19 2 0 0 0 0 14 37 1 0 0 0 0 15 22 2 0 0 0 0 15 23 1 0 0 0 0 15 24 1 0 0 0 0 17 26 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 22 1 0 0 0 0 20 42 1 0 0 0 0 21 23 2 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 28 29 1 0 0 0 0 28 30 2 0 0 0 0 28 31 1 0 0 0 0 30 32 1 0 0 0 0 30 50 1 0 0 0 0 31 33 2 0 0 0 0 31 51 1 0 0 0 0 32 34 2 0 0 0 0 32 52 1 0 0 0 0 33 34 1 0 0 0 0 33 53 1 0 0 0 0 M END $$$$