D08USU -OEChem-10101305022D 41 43 0 1 0 0 0 0 0999 V2000 8.9192 0.3870 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2568 0.1071 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.2542 -1.6347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5591 -2.9252 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2064 -2.3900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0269 -0.4315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1372 2.9164 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8094 2.4646 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9681 -0.9220 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2542 0.7907 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9681 0.0780 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.5070 -0.4220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9192 -1.2310 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9598 0.0821 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9598 -0.9262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3160 0.1658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3160 -1.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2282 -2.1821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2878 0.5338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5821 1.2424 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6156 0.9856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8429 2.2078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8398 1.6165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2554 0.0527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8369 0.9178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4808 -1.6694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1989 0.6542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6804 -0.3358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8176 0.5302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9516 0.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9516 -1.5114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8176 -1.3742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6804 -0.5082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4159 1.3892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1446 1.6817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7507 -3.5149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8735 2.2356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -0.4679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4216 1.2970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2989 3.5149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 15 2 0 0 0 0 4 18 1 0 0 0 0 4 37 1 0 0 0 0 5 18 2 0 0 0 0 6 19 2 0 0 0 0 7 22 1 0 0 0 0 7 41 1 0 0 0 0 8 22 2 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 9 15 1 0 0 0 0 14 10 1 1 0 0 0 10 19 1 0 0 0 0 10 35 1 0 0 0 0 11 14 1 0 0 0 0 11 26 1 6 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 17 1 0 0 0 0 13 18 1 6 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 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 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 20 19 1 6 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 36 1 0 0 0 0 21 23 1 0 0 0 0 21 24 2 0 0 0 0 23 25 2 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 M END $$$$