BGZ01I -OEChem-04012112563D 39 40 0 0 0 0 0 0 0999 V2000 -0.5563 1.1201 0.6290 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8926 -0.1256 -0.3861 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0792 -0.3015 -1.7403 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7684 1.4534 0.3158 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6533 -0.5302 -0.3177 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3551 1.8590 -0.2186 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4333 1.2179 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7363 2.0134 1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8825 0.8756 0.3838 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2846 2.3270 0.8027 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5875 0.0877 -0.6982 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5117 0.3992 0.1387 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9896 -0.9862 0.2243 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9982 -1.6297 1.4458 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5098 -1.5919 -0.9201 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9661 0.5927 -0.1581 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5069 -2.9327 1.5265 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0185 -2.8949 -0.8393 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -3.5652 0.3839 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9591 -0.3190 -0.5838 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6699 1.9969 -0.4878 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5285 0.9341 -0.6815 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4084 1.7945 -0.8983 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8848 0.2879 -0.1598 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2776 2.9485 1.3291 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7667 1.4241 2.0705 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9089 0.2799 1.3031 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4448 1.8020 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2352 2.9212 -0.1176 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8355 2.9067 1.6177 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3776 -1.1422 2.3391 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5073 -1.0747 -1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5055 -3.4545 2.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3634 -3.3874 -1.7288 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3658 -4.5796 0.4468 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3590 -0.6271 -1.0884 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5550 -1.2150 -0.7209 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0265 3.0198 -0.5454 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5794 1.0742 -0.8961 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 10 1 0 0 0 0 2 11 1 0 0 0 0 2 36 1 0 0 0 0 3 11 2 0 0 0 0 4 12 2 0 0 0 0 5 16 1 0 0 0 0 5 20 2 0 0 0 0 6 16 2 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 7 24 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 14 17 1 0 0 0 0 14 31 1 0 0 0 0 15 18 2 0 0 0 0 15 32 1 0 0 0 0 17 19 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 20 22 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 39 1 0 0 0 0 M END $$$$