DR1789 -OEChem-05042003463D 25 25 0 1 0 0 0 0 0999 V2000 4.5627 1.1014 -0.4389 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9807 -0.5909 0.5118 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8905 1.0840 -0.7857 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0012 0.9946 1.3006 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9354 -0.2527 -0.4921 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3095 -0.2123 0.2915 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3301 -1.1607 0.2213 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6045 1.1423 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5591 -1.5411 -0.9996 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6452 -0.7545 -0.0043 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0329 -2.6149 0.3852 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9196 1.5483 -0.0899 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9400 0.5999 -0.1601 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9776 0.6567 0.1242 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4713 0.2825 -1.3307 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0471 -2.0872 -0.1841 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7924 -2.2045 -1.4132 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3074 -1.3500 -1.7751 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1768 1.8948 0.1984 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 -1.4928 -0.0608 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9476 -3.2071 0.4967 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4277 -2.7873 1.2814 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4936 -2.9910 -0.4899 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1349 2.6073 -0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5576 1.6795 -0.3825 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 3 14 1 0 0 0 0 3 25 1 0 0 0 0 4 14 2 0 0 0 0 5 9 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 7 10 1 0 0 0 0 7 11 1 0 0 0 0 8 12 2 0 0 0 0 8 19 1 0 0 0 0 9 16 1 0 0 0 0 9 17 1 0 0 0 0 9 18 1 0 0 0 0 10 13 2 0 0 0 0 10 20 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 M END $$$$