LBIV29 -OEChem-05022322013D 27 28 0 0 0 0 0 0 0999 V2000 -2.0645 2.0134 -0.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5838 -3.2502 0.1705 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6092 1.3676 -0.1754 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3579 -1.2941 0.0974 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3183 0.3950 -0.1357 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0608 -0.9528 0.0023 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9011 1.0056 -0.0786 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2701 -0.3064 0.0558 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6714 0.7118 -0.2315 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9271 -1.9341 0.0396 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6521 -0.2778 -0.1932 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2783 -1.6064 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9095 2.1012 -0.1262 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6999 -0.7106 0.1632 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 2.7381 0.8349 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7038 -0.0168 -0.2698 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0441 -2.3764 -0.0279 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5820 1.9729 -0.9801 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4203 3.0752 -0.2357 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4957 2.1296 0.7976 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1658 -0.2590 1.0447 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7903 -1.7978 0.2636 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 -0.4158 -0.7328 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3919 -3.7915 0.1778 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6023 3.7579 0.5663 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4119 2.7830 1.4548 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1326 2.2796 1.3974 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 15 1 0 0 0 0 2 10 1 0 0 0 0 2 24 1 0 0 0 0 3 5 1 0 0 0 0 3 7 2 0 0 0 0 4 6 1 0 0 0 0 4 8 2 0 0 0 0 5 6 1 0 0 0 0 5 9 2 0 0 0 0 6 10 2 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 8 14 1 0 0 0 0 9 11 1 0 0 0 0 10 12 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 17 1 0 0 0 0 13 18 1 0 0 0 0 13 19 1 0 0 0 0 13 20 1 0 0 0 0 14 21 1 0 0 0 0 14 22 1 0 0 0 0 14 23 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 M END $$$$