MMs02349535 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 58 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 0.0057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 -1.2904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7549 -1.2847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7450 1.3134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 1.3076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0230 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9942 1.5230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0057 -1.4770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 0.0287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2450 1.3306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7450 1.3364 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.1450 2.3756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6220 2.5533 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.7734 3.4018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0503 2.0952 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.2094 1.7846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0561 0.5952 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.7455 -0.5639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6313 0.1262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2730 -0.2818 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.6978 0.1872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5841 -1.0230 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.7071 -2.2399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2787 -1.7818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1678 -2.7898 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0252 -2.4233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4853 -4.2558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9137 -4.7138 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.0245 -3.7059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4529 -4.1639 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9273 3.3121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0410 4.5222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6162 4.0533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1341 5.5494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6473 5.9696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0046 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0046 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6589 -2.3319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3589 -2.3216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3410 2.3549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 2.3446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1158 1.7367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4488 2.5132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0642 1.3299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5966 -5.0621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9559 4.6750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0086 6.3712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3124 6.4239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8052 6.2847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3322 7.1275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4893 5.6546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 7 44 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 35 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 33 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 31 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 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 31 32 2 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 37 1 0 0 0 0 36 49 1 0 0 0 0 36 50 1 0 0 0 0 36 51 1 0 0 0 0 37 52 1 0 0 0 0 37 53 1 0 0 0 0 37 54 1 0 0 0 0 M END