MMs01444279 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 46 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 1.1330 -0.9830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5508 -0.4932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8356 0.9795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2534 1.4693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3864 0.4863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1017 -0.9864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6839 -1.4762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8042 0.9760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9373 -0.0069 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3550 0.4828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4881 -0.5002 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9059 -0.0104 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1906 1.4623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0576 2.4453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6398 1.9555 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.6084 1.9521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0456 3.3869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5453 3.4146 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.2326 4.3983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0351 1.9968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8380 1.0929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0223 -0.3957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4036 -0.9805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6007 -0.0766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4164 1.4121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7864 0.9064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9064 0.7864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7864 -0.9064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9292 1.7659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4812 2.6474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0081 -1.7728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4561 -2.6544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2214 2.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7360 1.7321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7094 -1.1851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8123 -0.7968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2854 3.6235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3225 4.3446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0646 -1.1189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5510 -2.1714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7057 -0.5444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3741 2.1352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 M END