BDJQ81 -OEChem-04022103192D 40 41 0 1 0 0 0 0 0999 V2000 6.0010 2.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 4.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5369 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9399 -0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3249 -0.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9264 -1.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8796 -1.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 -0.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9264 -1.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3249 -2.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 -2.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8796 -1.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 0.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8796 1.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2269 -3.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8469 -4.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 4.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 2 18 1 0 0 0 0 3 14 2 0 0 0 0 4 10 1 0 0 0 0 4 11 1 0 0 0 0 4 14 1 0 0 0 0 9 5 1 6 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 21 1 0 0 0 0 7 10 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 11 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 12 1 0 0 0 0 9 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 20 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 M END $$$$