B8KF4D -OEChem-04022108152D 28 28 0 1 0 0 0 0 0999 V2000 4.7770 -1.2151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4223 -1.1640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9575 0.4833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7985 1.7704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -0.5157 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3122 0.4322 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 0.0721 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3090 1.0231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 1.0231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.0721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5691 -0.2369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2633 0.1232 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4712 -0.8550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0064 0.7923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 -0.5403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9155 1.1520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2442 1.6397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3738 1.6397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7026 1.1520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4336 0.3242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.4649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -1.1357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1833 1.0386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1344 0.7296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8516 -0.8766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3849 -1.4689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5512 -1.7704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4182 0.8981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 2 0 0 0 0 2 13 1 0 0 0 0 2 27 1 0 0 0 0 3 14 1 0 0 0 0 3 28 1 0 0 0 0 4 14 2 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 5 22 1 0 0 0 0 6 11 1 0 0 0 0 12 6 1 6 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 1 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 16 1 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 9 19 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 M END $$$$