MMs01415654 MOE2007 2D CORINA 3.40 0006 02.08.2006 31 31 0 0 1 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 1.3031 0.7429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0141 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5980 1.1859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5899 -1.5141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9011 0.7288 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0282 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4390 -1.3232 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9531 1.2667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4910 -0.7853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4829 -2.2853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7778 -3.0423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0809 -2.2994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0891 -0.7994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6871 -0.8135 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5943 1.0425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0425 -0.5943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5943 -1.0425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5368 1.6664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0794 1.6580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3899 -1.5076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5834 -2.7141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7899 -1.5206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9077 1.9288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4404 -2.8796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7713 -4.2423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1169 -2.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8006 1.1576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4003 1.4435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 2 0 0 0 0 M CHG 1 17 -1 M END