BBTK64 -OEChem-04012118242D 27 28 0 0 0 0 0 0 0999 V2000 3.7891 0.6553 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3238 4.2425 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.0035 3.7357 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.8306 2.9222 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.5158 2.3109 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.9325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.4325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.9325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 1.6064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 0.6553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.4325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 1.6064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.4325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.4325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.4325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.9325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5103 2.4154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 3.3289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.9325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9967 0.4637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -1.1225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4625 2.1080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.1225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.7425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.5525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -4.2425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 2 19 1 0 0 0 0 3 19 1 0 0 0 0 4 19 1 0 0 0 0 5 18 2 0 0 0 0 6 20 1 0 0 0 0 6 27 1 0 0 0 0 7 20 2 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 8 14 1 0 0 0 0 9 11 2 0 0 0 0 10 13 2 0 0 0 0 10 18 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 12 15 1 0 0 0 0 12 22 1 0 0 0 0 13 23 1 0 0 0 0 14 16 2 0 0 0 0 14 24 1 0 0 0 0 15 17 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 M END $$$$