MMs01305777 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 58 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 1.2960 -0.7553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2899 -2.2553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 -0.7658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2022 1.4789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5043 2.2236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8003 1.4683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4921 -0.7764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0901 -0.7870 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6882 -0.7975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6821 -2.2975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 -0.0528 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2863 -0.8081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2802 -2.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5761 -3.0634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8782 -2.3186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8843 -0.8187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 -0.0634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1742 -3.0739 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 18.9295 -1.7779 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4189 -4.3699 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.4702 -3.8292 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.7722 -3.0845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7783 -1.5845 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 22.0804 -0.8398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.3764 -1.5951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.3703 -3.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0682 -3.8398 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6042 1.0368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0368 0.6042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6042 -1.0368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2567 -1.3553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0899 -2.2504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -3.4553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4899 -2.2601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8305 0.9118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3731 0.9055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1654 2.0831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5092 3.4236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8419 2.0641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4872 -1.9764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6246 0.8801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1673 0.8739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9952 1.1472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2385 -2.9038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5713 -4.2633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9260 -0.2229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5932 1.1366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4653 -5.0292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.0853 0.3602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.4181 -0.9993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.4071 -3.6993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 9 10 2 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 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 48 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 22 52 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 2 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 31 56 1 0 0 0 0 M END