MMs00009090 MOE2007 2D CORINA 3.40 0006 02.08.2006 21 20 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 -0.0087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2575 1.2859 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8575 2.3252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7575 1.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5150 2.5719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7575 -1.2947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2575 -1.2859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0151 -2.5806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2152 1.1805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1252 0.4170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2847 -1.1893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6252 -0.4257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3677 -1.7116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9728 -2.4752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0262 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5151 2.5893 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5578 3.1833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9211 3.6320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4724 1.9954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 0.0175 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 17 1 0 0 0 0 5 6 2 0 0 0 0 5 16 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 7 15 1 0 0 0 0 8 9 2 0 0 0 0 8 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 M CHG 1 16 -1 M CHG 1 17 1 M CHG 1 21 -1 M END