D06JRD -OEChem-04152109082D 38 39 0 1 0 0 0 0 0999 V2000 5.0289 2.8475 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5202 -0.9442 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6167 3.6565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2199 3.4353 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8379 2.2597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 -0.6351 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -1.2229 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8479 1.1249 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.2601 0.3159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 0.3159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5691 -0.6351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4411 2.0385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -2.2229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6723 1.1249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.9442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8424 1.0204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -2.7229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -2.7229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -3.7229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -3.7229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -4.2229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0104 2.4845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9271 1.6918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1739 1.4894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3079 1.6265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1707 0.7605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8084 -0.3545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4103 -1.1357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1916 -1.5338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7776 0.4038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4590 0.9556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9072 1.6370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 -2.4129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -2.4129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 -4.0329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -4.0329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -4.8429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3645 4.2229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 12 1 0 0 0 0 2 11 2 0 0 0 0 3 38 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 15 1 0 0 0 0 7 11 1 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 16 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 10 14 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 13 17 2 0 0 0 0 13 18 1 0 0 0 0 14 24 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 19 1 0 0 0 0 17 33 1 0 0 0 0 18 20 2 0 0 0 0 18 34 1 0 0 0 0 19 21 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 M END $$$$