MMs01063906 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 60 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 1.5000 0.0092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2579 -1.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7579 -1.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 1.3220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 1.3128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0367 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7419 1.3403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7578 -1.2577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0158 -2.5613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2578 -1.2485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0157 -2.5429 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2737 -3.8465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5157 -2.5337 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.5065 -1.0338 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5249 -4.0337 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0157 -2.5246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7577 -1.2210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2577 -1.2118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0156 -2.5062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2736 -3.8098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7736 -3.8190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2841 -4.9184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6506 -4.2999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4847 -2.8091 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.3716 -2.0007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8695 -5.1741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7219 -6.6668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3553 -7.2853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1364 -6.4111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0073 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0073 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6643 -2.3281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3642 -2.3116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3356 2.3649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6357 2.3483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7848 0.7467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3355 2.3832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6990 1.9340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0422 -0.0680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3829 -0.8312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2308 -3.2529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6801 -4.8894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3166 -4.4402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1514 -0.1854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8513 -0.1689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1800 -4.8619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3890 -4.0924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0251 -5.4978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9184 -6.5758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0193 -7.8294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0324 -8.2760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4972 -8.1242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9809 -6.0874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6170 -7.4928 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 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 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 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 31 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 M END