MMs01879819 MOE2007 2D CORINA 3.40 0006 02.08.2006 67 67 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 1.2953 -0.7564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2561 -1.3564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2879 -2.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0128 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5980 -1.2128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6054 1.4872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3101 2.2436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8934 -0.7692 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2035 1.4744 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4914 -0.7820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4914 0.4180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4840 -2.2820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7793 -3.0384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0821 -2.2948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0821 -3.4948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0895 -0.7948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3774 -3.0512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6801 -2.3076 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9754 -3.0640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9680 -4.5640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2781 -2.3204 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.2781 -3.5204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2855 -0.8205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5735 -3.0768 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.8762 -2.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1715 -3.0897 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8836 -0.8333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1863 -0.0897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9299 -1.3924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4427 1.2130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4890 0.6539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6051 1.0363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0363 0.6051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6051 -1.0363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0879 -2.2505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -3.4564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4879 -2.2623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8874 -1.9692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3033 -2.0678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0680 -3.4076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0035 -3.9538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5461 -3.9615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2702 -1.0090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5054 0.3308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0273 0.8846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5700 0.8770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6015 -3.9667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1442 -3.9743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6860 -1.1076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4855 -0.8264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2915 0.3795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0856 -0.8145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5676 -4.2768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8877 -1.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5248 -2.4346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4510 -1.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9638 1.5105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8479 2.2552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4006 0.6182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7865 0.1328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5312 1.2488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1916 1.1750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9082 2.2308 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9141 3.4307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 4 40 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 66 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 20 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 52 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 26 1 0 0 0 0 24 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 66 67 1 0 0 0 0 M END