LIGS20 -OEChem-05022321242D 29 30 0 0 0 0 0 0 0999 V2000 2.4598 0.0526 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 2.7262 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1349 -3.0352 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 1.8126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7688 1.0036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2688 -0.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7688 1.0036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0778 0.0526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2688 -1.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 2.8307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4028 -2.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1349 -2.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4028 -3.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2688 -3.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 2.1594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7504 1.3667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1333 1.5052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 -0.1390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5016 3.8996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6356 4.0368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4984 3.1708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6471 2.2141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1989 2.8955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5175 3.4473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8659 -1.7252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6718 -1.7252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8659 -3.3452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2688 -4.1552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 2 11 1 0 0 0 0 3 13 1 0 0 0 0 3 15 2 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 4 17 1 0 0 0 0 5 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 19 1 0 0 0 0 9 12 1 0 0 0 0 9 13 2 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 14 2 0 0 0 0 12 26 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 M END $$$$