MMs03679137 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 0.7462 -1.3012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0077 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7385 -3.8993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2385 -3.9037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9923 -2.6069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2462 -1.3057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9846 -5.2050 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2859 -4.4588 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6834 -5.9512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7308 -6.5062 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2308 -6.5107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9846 -5.2139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2385 -3.9126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4846 -5.2183 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2384 -3.9215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7384 -3.9259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4923 -2.6291 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.9923 -2.6335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7461 -1.3367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2461 -1.3411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9923 -2.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2384 -3.9392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7384 -3.9348 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9770 -7.8031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -7.7986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7231 -9.0954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4693 -10.3967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9693 -10.4011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7231 -9.1043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2231 -9.1087 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 0.5969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5969 1.0410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0410 -0.5969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2077 -2.5945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1354 -4.9368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1923 -2.6105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8492 -0.2682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0189 -7.6918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3572 -6.9244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0815 -6.2593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1120 -3.5077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4503 -2.7403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5266 -5.1071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8649 -4.3397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1492 -0.2957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8492 -0.3037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1923 -2.6459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8353 -4.9802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -6.7576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4769 -9.0919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8662 -11.4341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5662 -11.4421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 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 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 M END