MMs00198706 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 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 1.2979 -0.7520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2955 -2.2520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5934 -3.0041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8936 -2.2561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8959 -0.7561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1915 -3.0081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4917 -2.2601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7895 -3.0122 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7895 -1.8122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0897 -2.2642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3876 -3.0162 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6878 -2.2683 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.4358 -3.5685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9398 -0.9680 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9880 -1.5203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9904 -0.0203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2906 0.7277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5884 -0.0243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5861 -1.5243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2859 -2.2723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2835 -3.7723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9833 -4.5203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7872 -4.5122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6016 1.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0383 0.6016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6016 -1.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2554 -2.8504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5915 -4.2041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9361 -0.1577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5999 1.1959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7218 -1.3397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2644 -1.3421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3198 -1.3437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8625 -1.3461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3857 -4.2162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9521 0.5813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2924 1.9277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6286 0.5740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6244 -2.1260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7470 -5.1105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5814 -4.5243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5795 -5.7243 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 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 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 16 2 0 0 0 0 14 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 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 25 42 1 0 0 0 0 43 44 1 0 0 0 0 M END