MMs01066678 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.2934 -0.7596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8915 -0.7788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0385 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4895 -0.7981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4784 -2.2980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8051 1.4422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1097 2.1826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4031 1.4230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 -0.0769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0875 -0.8173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6855 -0.8365 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9900 -0.0962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2835 -0.8558 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0011 1.4038 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.0011 2.6038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7077 2.1634 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.6715 1.5239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6834 2.6312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9430 3.9357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4735 3.6347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6077 1.0348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0348 0.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6077 -1.0348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8335 0.9057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3761 0.8943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1133 -1.6924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6560 -1.7038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2049 1.1615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7704 2.0499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1186 3.3826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0786 -2.0173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6766 -2.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6370 0.8114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0638 0.4891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4797 1.7335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6594 3.3293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0428 4.4157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5807 5.0797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3569 4.8290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2736 3.6436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3057 2.1441 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 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 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 44 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 M END