MMs02728000 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 64 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 1.3022 0.7446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3084 2.2445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6106 2.9891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6169 4.4891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 5.2445 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0188 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0125 3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2771 5.2554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5792 4.5108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9190 5.2337 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2149 4.4782 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4595 3.1823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9704 5.7741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5108 3.7228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8130 4.4674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1089 3.7119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1026 2.2120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8004 1.4674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5045 2.2228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3985 1.4565 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7007 2.2011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7069 3.7011 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9965 1.4457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2987 2.1902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5946 1.4348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 -0.0652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2862 -0.8098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 -0.0543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8842 -0.8206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1864 -0.0761 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.4823 -0.8315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7844 -0.0869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0803 -0.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0740 -2.3423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7719 -3.0869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4760 -2.3315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.3699 -3.0978 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.5956 1.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0417 -0.5956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5956 -1.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6473 2.3848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1749 5.5526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6210 3.9152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9836 3.4691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9241 6.4336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8180 5.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1506 4.3076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7954 0.2674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4628 1.6272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3935 0.2565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3037 3.3902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6363 2.0304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2811 -2.0097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9485 -0.6500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1090 -1.7366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6517 -1.7431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7894 1.1131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.1220 -0.2467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7669 -4.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4343 -2.9271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 51 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 29 2 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 58 1 0 0 0 0 34 35 1 0 0 0 0 34 59 1 0 0 0 0 35 36 2 0 0 0 0 35 38 1 0 0 0 0 36 37 1 0 0 0 0 36 60 1 0 0 0 0 37 61 1 0 0 0 0 M END