MMs00436881 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 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 1.5000 -0.0070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2439 -1.3095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7439 -1.3165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7439 -1.3305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9878 -2.6260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4878 -2.6190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2439 -1.3375 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6439 -0.2983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0420 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5999 0.9973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 -0.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2559 1.2466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2438 -1.3515 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4878 -2.6470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2317 -3.9495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9878 -2.6400 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5878 -3.6793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2317 -3.9356 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.7318 -3.9286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9757 -5.2241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7196 -6.5266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2196 -6.5336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9757 -5.2381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2560 1.2605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5120 2.5631 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0056 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0056 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2971 1.1757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6295 0.3982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9048 1.0210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6048 1.0084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2854 -3.1470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8830 -3.6555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4438 -1.3571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4342 -3.4075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7757 -5.2185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1148 -7.5630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8148 -7.5756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1757 -5.2437 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 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 27 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 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 22 39 1 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 27 28 3 0 0 0 0 M CHG 1 21 1 M END