MMs02598652 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 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 1.4624 -0.3336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5919 0.6534 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8797 -0.1158 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5461 -1.5782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0521 -1.7129 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2829 -3.0006 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2169 -2.9783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9862 -4.2661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2555 -5.5761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0248 -6.8639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5246 -6.8416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2552 -5.5315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4860 -4.2438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7550 -5.5093 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5331 -2.7078 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0048 -2.4177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9918 -3.5472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5071 -4.9668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4942 -6.0963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9658 -5.8062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4505 -4.3867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4635 -3.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9482 -1.8376 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.9529 -6.9357 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.2669 1.1699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1699 0.2669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2669 -1.1699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8014 -1.9303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9443 -5.5939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4403 -7.9119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1400 -7.8718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0705 -3.1958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3704 -6.5395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5718 -1.2985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0318 -1.7970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3298 -5.1988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1064 -7.2319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6279 -4.1547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 M END