MMs01849401 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 44 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 -0.7557 -1.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0114 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4886 -2.6046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2443 -1.3089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -0.0066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2557 1.2892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7557 1.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6426 2.4923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1854 3.9209 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0672 2.0225 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0606 0.5225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6320 0.0652 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4852 0.0527 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3721 1.2624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4958 2.4798 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8721 1.2558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6278 2.5516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1278 2.5450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8721 1.2427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1164 -0.0530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6164 -0.0465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3721 1.2361 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.7671 -3.8938 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2670 -3.8872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0227 -5.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2784 -6.4853 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5227 -5.1764 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5954 1.0418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9557 -1.2905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0841 -3.6465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4443 -1.3141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6602 2.3310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0324 3.5934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7323 3.5816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7119 -1.0949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0119 -1.0831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0535 -2.7064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3929 -3.4719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1182 -4.1346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1273 -6.2130 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 33 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 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 40 1 0 0 0 0 28 41 1 0 0 0 0 M END