MMs02606077 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 57 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 1.5000 -0.0062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2446 -1.3084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7446 -1.3146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7446 -1.3270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9892 -2.6229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4892 -2.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9882 -3.7418 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.3611 -3.1374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2105 -1.6450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6570 -3.8928 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0298 -3.2884 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.1889 -2.9778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0289 -4.4072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2735 -5.7032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8076 -5.3852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6887 -6.3843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8779 -7.0760 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5213 -4.2566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1371 -2.8889 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3979 -5.4738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8904 -5.3232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7670 -6.5404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1512 -7.9082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6588 -8.0588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7822 -6.8416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3478 -1.8225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7763 -1.3648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0942 0.1011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9837 1.1094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5552 0.6518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2372 -0.8141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3016 2.5753 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2965 1.1764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6293 0.3995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9043 1.0230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6043 1.0118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8849 -3.6535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3310 -2.7684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3830 -4.2290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9609 -6.4199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8525 -8.8819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1662 -9.1530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5882 -6.9621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6647 -2.1715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2370 0.4671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6667 1.4584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0944 -1.1802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 29 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 1 0 0 0 0 17 20 2 0 0 0 0 18 19 2 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 52 1 0 0 0 0 34 53 1 0 0 0 0 M END