MMs00761818 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 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 1.2969 0.7536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8950 0.7609 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9342 1.3609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8908 2.2609 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5897 3.0072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5855 4.5072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2928 2.2536 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2003 -1.4855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5014 -2.2319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7984 -1.4782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4931 0.7681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0911 0.7754 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 10.3923 0.0290 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0869 2.2754 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.6023 -1.4927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9034 -2.2391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3053 -2.2464 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3095 -3.7464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0126 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0168 -6.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2802 -6.7536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6029 1.0376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0376 -0.6029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6029 -1.0376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9284 2.8638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2518 2.8507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6815 -1.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5048 -3.4318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4897 1.9681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4907 -3.5347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7231 -4.8728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 -3.3735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1686 -4.7117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8831 -5.7161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3177 -7.3565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6773 -7.7912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0995 -2.2246 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1029 -3.4246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END