MMs01797608 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 55 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 -0.7430 -1.3031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -1.3112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0162 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6000 1.0230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 1.2869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0140 2.5818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0243 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1055 1.0117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2429 -1.3274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4859 -2.6223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7429 -1.3355 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.9429 -1.3355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4859 -2.6385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7289 -3.9335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4718 -5.2366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2289 -3.9254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4999 -0.0405 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7569 1.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5139 2.5575 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0139 2.5494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7709 3.8444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2709 3.8363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0139 2.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2569 1.2383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7569 1.2464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9999 -0.0486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7428 -1.3517 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0425 -0.5944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5944 1.0425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0425 0.5944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 -1.3031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0219 -3.2036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6196 -3.6340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -1.9924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0282 -2.4918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3683 -1.7277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4093 -1.8722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4009 -3.4148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1289 -4.9727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5143 -4.6422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0662 -6.2790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4294 -5.8310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2224 -5.1254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0289 -3.9189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2354 -2.7254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5569 1.2690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1765 4.8868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8765 4.8723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2138 2.5267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8512 0.1958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 1.2950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1626 2.3374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 53 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 18 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 17 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 28 1 0 0 0 0 20 21 2 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 53 54 1 0 0 0 0 M END