MMs02038545 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 0.7485 -1.2999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2485 -1.3016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0051 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2515 1.2930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5030 2.5929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7515 1.2913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5030 2.5895 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0030 2.5878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7545 3.8860 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3545 2.8467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0059 5.1859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5143 5.3444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2041 6.8119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5040 7.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6176 6.5555 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.2545 3.8842 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1375 5.0968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5636 4.6316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5619 3.1316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1347 2.6697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8212 1.2028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9348 0.1979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3619 0.6598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6754 2.1266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9970 -2.6015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2455 -3.8997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0399 0.5988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5988 1.0399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0399 -0.5988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6485 -2.3408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8728 0.4083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2097 1.1781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0988 -1.0451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9042 3.6294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7932 1.4062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1301 2.1761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7104 4.4535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1085 7.3013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6308 8.7537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0990 5.6979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6269 6.1925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8144 5.8051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7569 4.5048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6795 0.8333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6839 -0.9756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2527 -0.1442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8171 2.4961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -3.2985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6444 -4.9382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2841 -4.5009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 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 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 M END