MMs03163856 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 53 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 1.5000 -0.0091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2421 -1.3127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 -1.3218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7578 1.2762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2579 1.2853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5158 2.5889 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0365 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7420 -1.3401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9841 -2.6345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2419 -1.3492 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9840 -2.6528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4840 -2.6619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2419 -1.3674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4998 -0.0639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 -0.0547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1162 -2.5863 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5456 -2.1315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5547 -0.6315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1309 -0.1593 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.6440 -4.0100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1749 -4.3130 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6409 -5.1308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3201 -6.5961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6145 -7.3540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7353 -6.3571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1336 -4.9831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0073 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0073 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6357 -2.3483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3357 -2.3647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3641 2.3118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6062 0.9991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8539 -3.0563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1852 -3.8358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2684 -3.8424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6091 -3.0792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6299 0.3397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2986 1.1192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8747 0.3625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2154 1.1257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7879 -3.3067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7397 -2.0133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7473 -0.7642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8113 0.5408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2209 -7.0775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7327 -8.5482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9076 -6.6137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 M END