MMs02086958 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 48 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 0.7528 1.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0056 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4944 2.6013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2472 1.3039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 0.0032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2528 -1.2942 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7528 -1.2910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0097 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5056 -2.5884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0056 -2.5851 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4056 -3.6244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7584 -3.8826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2584 -3.8793 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2528 -1.2813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0000 0.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5000 0.0226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2472 1.3233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7472 1.3265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4944 2.6271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7584 3.8955 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5978 -1.0405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9528 1.2948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0922 3.6418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4472 1.3065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 -2.3347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3788 -3.0012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7165 -3.7697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3813 -1.6893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0469 -2.4635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8715 0.4274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2058 1.2016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2941 -1.1596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6285 -0.3854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1187 1.7313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4530 2.5055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5413 0.1443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8757 0.9185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3659 3.0351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7002 3.8094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5921 3.6709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9584 3.8929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0112 -5.1832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7528 -1.2845 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1505 -0.2466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9944 2.6304 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.5966 1.5924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6134 -6.2212 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 44 1 0 0 0 0 13 14 2 0 0 0 0 13 43 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 46 1 0 0 0 0 21 42 1 0 0 0 0 41 46 1 0 0 0 0 43 48 1 0 0 0 0 44 45 1 0 0 0 0 46 47 1 0 0 0 0 M END