MMs02594602 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 -1.3719 0.6066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2189 2.0988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2475 2.4144 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7327 3.5119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0008 1.1173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3362 3.0996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7616 2.6324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9774 3.5109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9813 5.0109 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1887 2.6261 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7215 1.2007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6000 -0.0151 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.2215 1.2046 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.6164 3.0860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9321 4.5524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3599 5.0122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4720 4.0057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1563 2.5392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7286 2.0794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2685 1.5327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9528 0.0663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.8998 4.4655 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2525 -1.1731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4096 0.0039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1946 0.9949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0898 4.2740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0424 5.3576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6124 6.1853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4761 0.9063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1523 5.6386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6962 1.9925 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.5859 1.1873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 14 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 28 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 30 1 0 0 0 0 21 22 2 0 0 0 0 21 32 1 0 0 0 0 23 31 1 0 0 0 0 32 33 1 0 0 0 0 M END