MMs01229461 MOE2007 2D CORINA 3.40 0006 02.08.2006 23 23 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 -0.7609 -1.2927 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2609 -1.2800 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2482 0.2200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2736 -2.7799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7608 -1.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4998 0.0380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9998 0.0507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7607 -1.2420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0217 -2.5473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5218 -2.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7828 -3.8653 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.7388 1.3560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9778 2.6486 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0341 -0.6088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6088 1.0341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0341 0.6088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1697 -2.3369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8911 1.0721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9607 -1.2319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6305 -3.5814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2387 1.3687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8299 2.4129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 19 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 20 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 13 14 2 0 0 0 0 13 22 1 0 0 0 0 22 23 1 0 0 0 0 M END