MMs01305853 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 36 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 1.5000 -0.0109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2405 -1.3154 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0405 -1.3154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 -2.6089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7404 -1.3263 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1404 -0.2871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4809 -2.6308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7215 -3.9243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0328 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9075 1.0108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 -0.0437 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0108 1.4562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9889 -1.5437 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 -0.0547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2403 -1.3591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7403 -1.3701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4997 -0.0765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7592 1.2279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2593 1.2389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5187 2.5433 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 10.4808 -2.6746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9807 -2.6855 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0087 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0087 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3002 1.1723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6306 0.3913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4462 -2.0014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8735 -3.6438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5158 -3.2165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6328 -2.3940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6997 -0.0853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3668 2.2628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9809 -2.6417 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 9.7213 -3.9681 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 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 29 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 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 32 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 36 2 0 0 0 0 M CHG 1 23 -1 M CHG 1 35 -1 M END