BS39UM -OEChem-04012115413D 38 40 0 0 0 0 0 0 0999 V2000 -3.4022 -3.1322 -0.0686 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2677 0.2783 -0.8348 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5299 1.7889 -0.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6713 -1.0677 -0.7026 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8107 -2.7016 0.5775 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3586 -0.1122 -0.7039 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6117 -0.2908 -1.4955 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1921 -1.7976 0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3515 -0.7024 -0.4619 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3384 0.7281 -0.6663 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9723 -2.2816 -0.0797 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4324 -1.8734 0.8631 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5422 0.3931 -0.0464 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8098 2.0101 -0.5161 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5079 -0.8858 0.6456 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2174 1.3399 0.7239 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4848 2.9570 0.2542 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7019 0.1695 1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6886 2.6219 0.8742 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3556 -0.9812 -0.4462 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7235 1.0842 1.2986 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5168 0.9006 0.1776 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3142 1.5547 -1.2356 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3245 -0.9501 -2.0023 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 0.2202 -2.2862 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7168 -3.5518 1.1203 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7233 -2.7235 1.4764 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9900 -0.5862 -0.1719 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8735 2.2854 -0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1582 1.0814 1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0734 3.9553 0.3709 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 0.2912 2.4024 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2150 3.3598 1.4725 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2562 -1.7818 -1.1734 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8878 1.9129 1.9787 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0724 2.3412 -1.2943 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7002 1.6101 -2.1409 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8317 0.5915 -1.1733 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 9 2 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 7 1 0 0 0 0 4 9 1 0 0 0 0 4 11 1 0 0 0 0 5 8 1 0 0 0 0 5 11 1 0 0 0 0 5 26 1 0 0 0 0 6 20 1 0 0 0 0 6 22 2 0 0 0 0 7 10 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 12 15 1 0 0 0 0 12 27 1 0 0 0 0 13 16 1 0 0 0 0 13 28 1 0 0 0 0 14 17 2 0 0 0 0 14 29 1 0 0 0 0 15 18 1 0 0 0 0 15 20 2 0 0 0 0 16 19 2 0 0 0 0 16 30 1 0 0 0 0 17 19 1 0 0 0 0 17 31 1 0 0 0 0 18 21 2 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 M END $$$$