MMs01140512 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 58 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 1.2964 -0.7545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0091 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8945 -0.7636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8892 -2.2636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5876 -3.0091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2912 -2.2545 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5823 -4.5091 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2807 -5.2545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2754 -6.7545 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2754 -7.9545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5718 -7.5090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8735 -6.7636 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8735 -7.9636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8787 -5.2636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1699 -7.5181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0262 -7.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1856 -3.0181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4873 -2.2727 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4925 -0.7727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7837 -3.0272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7784 -4.5272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0853 -2.2818 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3818 -3.0363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3765 -4.5363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6729 -5.2908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9746 -4.5454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9798 -3.0454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6834 -2.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2815 -2.2999 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6036 1.0371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0371 0.6036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6036 -1.0371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8742 -4.1255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0982 -5.4588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0859 -4.7005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0598 -5.4761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5663 -8.5552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2070 -8.1218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7735 -6.4810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6226 -6.4586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0675 -8.0963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5701 -8.5413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7984 -3.4764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9538 -3.9401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6736 -0.9852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9069 0.3535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4280 0.9038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9707 0.8984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0895 -1.0818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3352 -5.1327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6687 -6.4908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0117 -5.1490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6876 -1.0909 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 4 5 1 0 0 0 0 4 21 1 0 0 0 0 5 6 2 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 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 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 51 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 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 30 55 1 0 0 0 0 M END