D0A6AA -OEChem-10101305022D 27 30 0 0 0 0 0 0 0999 V2000 2.0000 0.7686 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9237 0.2067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9237 -1.4028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3515 -1.6327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2455 -0.0980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2455 -1.0980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9775 -0.0980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9775 -1.0980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1115 0.4020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4455 -0.0772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3515 0.4366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1115 -1.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5814 0.4261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4455 -1.1189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5074 -0.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4807 1.4210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6663 0.0229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5033 1.6327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1115 1.0220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3587 1.0566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1115 -2.2180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9097 -1.4309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9682 -1.0128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9682 -0.1833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 1.8341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5350 -0.5831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2533 2.2001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 7 1 0 0 0 0 2 15 1 0 0 0 0 3 8 1 0 0 0 0 3 15 1 0 0 0 0 4 6 2 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 11 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 8 12 2 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 14 2 0 0 0 0 11 20 1 0 0 0 0 12 21 1 0 0 0 0 13 16 1 0 0 0 0 13 17 2 0 0 0 0 14 22 1 0 0 0 0 15 23 1 0 0 0 0 15 24 1 0 0 0 0 16 18 2 0 0 0 0 16 25 1 0 0 0 0 17 26 1 0 0 0 0 18 27 1 0 0 0 0 M END $$$$