MMs01196741 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 -0.7524 1.2976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0049 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4951 2.6009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2476 1.3032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7476 1.3061 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7524 -1.2920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8839 -1.2006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3097 -0.7344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3068 0.7656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8794 1.2264 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7573 3.8957 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4018 4.2063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2494 4.0497 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 5.5163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9354 6.1239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2664 6.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1498 5.2672 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.2510 2.9331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7848 1.5074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7864 0.3908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2542 0.6999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7204 2.1256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7188 3.2422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1882 2.4348 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5981 -1.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3524 1.2965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0932 3.6412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1019 -1.0353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3456 2.3464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5153 -2.3426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2818 -1.4380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2763 1.4727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9735 7.2383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3761 7.0734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1977 1.3837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4134 -0.7498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0555 -0.1934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0917 4.3828 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 42 1 0 0 0 0 M END