MMs02594535 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -1.3170 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0746 -2.6720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1645 -3.7026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4815 -2.9846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2056 -1.5102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2362 -0.4203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6953 -0.7679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2718 -2.1527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4903 -3.4331 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7670 -2.0324 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1146 -0.5733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8342 0.2083 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.4994 0.0032 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6910 -0.9079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4978 -2.3954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6895 -3.3064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0743 -2.7300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2675 -1.2425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0758 -0.3314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6523 -0.6660 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -13.2659 -3.6410 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0536 -0.5744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5744 1.0536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0536 0.5744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1049 -2.8927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -4.8926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5655 -3.4993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8933 0.7297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6539 1.1932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3900 -2.8565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5349 -4.4964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2304 0.8586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 33 1 0 0 0 0 M END