DR2005 -OEChem-05042003562D 30 33 0 0 0 0 0 0 0999 V2000 4.5531 2.9476 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.5683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.0683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 -0.0337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 -2.1030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.0683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8648 0.9234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5882 0.9573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7168 1.4308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.5475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -1.5891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5882 -3.0940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8648 -3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7168 -3.5675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6971 2.4306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3256 1.2294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1149 1.2843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.2583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0678 -0.2354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0678 -1.9012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.8783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1149 -3.4210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3256 -3.3660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7046 -4.1873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4736 3.0090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0888 2.3110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5409 3.5675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 3 6 2 0 0 0 0 3 7 1 0 0 0 0 4 8 1 0 0 0 0 4 11 1 0 0 0 0 5 9 2 0 0 0 0 5 12 1 0 0 0 0 6 13 1 0 0 0 0 6 15 1 0 0 0 0 7 14 1 0 0 0 0 7 16 2 0 0 0 0 8 10 2 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 10 18 1 0 0 0 0 11 14 2 0 0 0 0 11 21 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 23 1 0 0 0 0 14 24 1 0 0 0 0 15 17 2 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 17 27 1 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 M END $$$$