MMs02545647 MOE2007 2D CORINA 3.40 0006 02.08.2006 23 23 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 -0.7543 -1.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2543 -1.2916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 0.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2457 1.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7457 1.3015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9914 2.6080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2371 3.9045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0148 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2543 -1.2817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7542 -1.2768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 0.0247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2457 1.3262 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5085 -2.5733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2628 -3.8699 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.0040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1577 -2.3378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8577 -2.3289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1423 2.3388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0965 1.0560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6577 -2.3229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4914 2.6129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0880 3.6541 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 16 1 0 0 0 0 2 3 2 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 2 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 10 11 2 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 3 0 0 0 0 14 15 3 0 0 0 0 22 23 1 0 0 0 0 M END