MMs02409619 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 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 -1.2967 -0.7541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 -2.2541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0094 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3061 -2.2459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3014 -0.7459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8994 -0.7378 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5934 1.5081 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8900 2.2622 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8508 2.8622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1914 1.5163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4881 2.2704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7895 1.5245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0862 2.2785 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8853 3.7622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5839 4.5081 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5886 -3.0081 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8900 -2.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1867 -3.0163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4881 -2.2704 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4881 -3.4704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4928 -0.7704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7942 -0.0245 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0909 -0.7785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0862 -2.2785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3828 -3.0326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3781 -4.5326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6842 -2.2867 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.6889 -0.7867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3923 -0.0326 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.7216 -2.8899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9903 -0.0408 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7848 -3.0244 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0038 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3378 -0.1573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0132 -4.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3472 -2.8426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5522 2.1049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4230 0.5946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9656 0.5995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7139 3.1872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 3.1920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5849 -4.2081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1216 -1.3406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6643 -1.3454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4125 -3.9331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9552 -3.9380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3104 -0.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0859 0.3585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7980 1.1755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9941 1.1592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0277 -0.6440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7810 -4.2244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0245 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.1820 4.5163 0.0000 O 0 5 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 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 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 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 55 1 0 0 0 0 16 17 2 0 0 0 0 16 56 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 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 22 1 0 0 0 0 21 23 1 0 0 0 0 21 34 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 31 1 0 0 0 0 26 27 1 0 0 0 0 26 34 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 32 1 0 0 0 0 30 31 2 0 0 0 0 30 33 1 0 0 0 0 33 52 1 0 0 0 0 33 53 1 0 0 0 0 34 54 1 0 0 0 0 M CHG 1 55 -1 M CHG 1 56 -1 M END