D00172 -OEChem-05072121462D 43 46 0 0 0 0 0 0 0999 V2000 6.9654 2.4508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9836 3.8907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8041 -3.9752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5361 -3.9752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 0.5248 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8611 1.1126 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1701 2.0636 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4791 1.1126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 -0.4752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4302 0.8036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1701 2.0636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 2.8726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8041 -0.9752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5361 -0.9752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1733 1.4727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6381 -0.1746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 3.7862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8041 -1.9752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5361 -1.9752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 -2.4752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 2.7681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1244 1.1637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5891 -0.4836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3323 0.1855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 4.5952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.5771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 4.4907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6701 -3.4752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2671 -0.6652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0730 -0.6652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1773 -0.5895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2671 -2.2852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0730 -2.2852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3356 2.2017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5851 1.5785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7180 -1.0901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9219 -0.0061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6534 5.1616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 3.5123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0423 4.9923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4262 2.8657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2357 4.4571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8041 -4.5952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 41 1 0 0 0 0 2 17 1 0 0 0 0 2 42 1 0 0 0 0 3 28 1 0 0 0 0 3 43 1 0 0 0 0 4 28 2 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 10 1 0 0 0 0 9 13 2 0 0 0 0 9 14 1 0 0 0 0 10 15 1 0 0 0 0 10 16 2 0 0 0 0 11 12 1 0 0 0 0 12 17 1 0 0 0 0 12 21 2 0 0 0 0 13 18 1 0 0 0 0 13 29 1 0 0 0 0 14 19 2 0 0 0 0 14 30 1 0 0 0 0 15 22 2 0 0 0 0 16 23 1 0 0 0 0 16 31 1 0 0 0 0 17 25 2 0 0 0 0 18 20 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 28 1 0 0 0 0 21 26 1 0 0 0 0 21 34 1 0 0 0 0 22 24 1 0 0 0 0 22 35 1 0 0 0 0 23 24 2 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 25 27 1 0 0 0 0 25 38 1 0 0 0 0 26 27 2 0 0 0 0 26 39 1 0 0 0 0 27 40 1 0 0 0 0 M END $$$$