MMs01319791 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 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 1.3755 -0.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5814 0.2939 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9569 -0.3044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1266 -1.7948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5021 -2.3930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7080 -1.5009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5383 -0.0106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1628 0.5877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0835 -2.0992 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2894 -1.2071 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.3973 -0.0012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1815 -2.4130 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4953 -0.3150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8708 -0.9132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0767 -0.0211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9070 1.4693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5315 2.0675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3256 1.1754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9501 1.7737 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 14.1129 2.3614 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 14.4522 -0.6194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6219 -2.1098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6581 0.2727 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.0336 -0.3255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2033 -1.8159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5788 -2.4142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7847 -1.5221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6150 -0.0317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2395 0.5666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8209 0.8604 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 18.7485 -3.9045 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.4786 1.1004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1004 0.4786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4786 -1.1004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7131 -1.5989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2459 -1.4244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1619 -2.5085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6378 -3.5853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5030 0.7031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0271 1.7800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2192 -3.2915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0065 -2.1055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3958 3.2598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5224 1.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2386 -2.5296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8851 -2.0007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1038 1.7589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 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 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 28 29 2 0 0 0 0 28 47 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 30 48 1 0 0 0 0 M END