B1KB7T -OEChem-04012113102D 28 29 0 0 0 0 0 0 0999 V2000 4.5981 -1.7102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.7102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.7102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.7102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7891 2.8776 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 2.8776 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 3.8286 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 3.8286 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.2898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.7102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.2102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.7898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.7898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.2102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.2898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.2102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.2102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.0998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.0998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.5202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 -2.3179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 -1.6276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.3267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.0998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.7472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7336 4.3302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.3302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 16 1 0 0 0 0 2 11 1 0 0 0 0 2 17 1 0 0 0 0 3 18 1 0 0 0 0 3 28 1 0 0 0 0 4 18 2 0 0 0 0 5 7 1 0 0 0 0 5 15 2 0 0 0 0 6 8 2 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 19 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 21 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 16 23 1 0 0 0 0 17 24 1 0 0 0 0 17 25 1 0 0 0 0 17 26 1 0 0 0 0 M END $$$$