MMs02777876 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 51 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 0.0076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2434 1.3105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2566 -1.2876 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7566 -1.2800 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7489 0.2200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7642 -2.7800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2565 -1.2724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0131 -2.5676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5131 -2.5599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2565 -1.2571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 0.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7565 -1.2495 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5131 -2.5447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7697 -3.8475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0130 -2.5371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7564 -1.2343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2564 -1.2266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0130 -2.5218 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2696 -3.8247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7696 -3.8323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0262 -5.1351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7828 -6.4303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2828 -6.4227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0262 -5.1199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9998 0.0762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3827 1.4434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4924 2.4527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7952 1.7094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4908 0.2406 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 18.1624 2.3264 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0061 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0061 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6619 -2.3299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4184 -3.6098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1184 -3.5961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0946 1.0804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3947 1.0666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3512 -0.2072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1512 -0.1981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8263 -5.1412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1881 -7.4726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8881 -7.4589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2262 -5.1138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2077 1.6869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3609 3.6455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 4 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 7 2 0 0 0 0 5 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 30 2 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 M END