MMs00468519 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 51 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 -0.7538 1.2968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2538 1.2925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2462 -1.3056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7462 -1.3012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2538 1.2837 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8538 2.3230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5076 2.5849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0076 2.5893 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2613 3.8818 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5151 5.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2689 6.4799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5227 7.7811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7538 1.2794 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 -0.0219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7462 -1.3187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0000 -0.0262 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7537 1.2706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2537 1.2662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0075 2.5631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9999 -0.0350 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2462 -1.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7462 -1.3275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9924 -2.6243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7386 -3.9255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2386 -3.9299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9924 -2.6331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1568 2.3378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5553 1.8112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8432 -2.3466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1432 -2.3387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2882 -1.1943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6264 -0.4268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4613 3.8783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5936 4.4143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5981 5.9570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3568 2.3168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6273 1.6843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9656 2.4518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1999 -0.0385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7924 -2.6208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1356 -4.9630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8356 -4.9709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1924 -2.6365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7689 6.4755 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3719 7.5130 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 16 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 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 48 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 2 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 48 49 1 0 0 0 0 M END