MMs02622817 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 53 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 1.3017 0.7454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3069 2.2454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6086 2.9909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6138 4.4909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3174 5.2454 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0158 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0105 3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2806 5.2545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5823 4.5091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9155 5.2363 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2119 4.4818 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9664 5.7782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4573 3.1854 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 3.7272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8100 4.4726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1064 3.7181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1011 2.2181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7994 1.4727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5030 2.2272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3975 1.4636 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6992 2.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7044 3.7090 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.9956 1.4544 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2972 2.1999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3025 3.6999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5936 1.4453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5884 -0.0547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8848 -0.8092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1864 -0.0638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1917 1.4362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8953 2.1908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9005 3.6908 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 -0.5964 1.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0413 -0.5964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5964 -1.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6457 2.3872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1786 5.5504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6236 3.9127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9859 3.4678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9197 6.4363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8142 5.6726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1477 4.3144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7952 0.2727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4617 1.6309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3933 0.2636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9914 0.2545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5470 -0.6510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8806 -2.0092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2235 -0.6674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2330 2.0326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 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 47 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 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 1 0 0 0 0 M END