MMs00274071 MOE2007 2D CORINA 3.40 0006 02.08.2006 30 31 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 1.3037 0.7419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 2.2419 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3523 1.6419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6167 2.9837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6261 4.4837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0187 2.9999 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3554 2.3984 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0554 1.8788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3521 3.5194 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2006 4.3679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7262 2.9178 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5787 1.4251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6997 0.4284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1135 1.1041 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5940 4.8137 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1288 4.4927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9922 5.4894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2968 0.5215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -0.5935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5935 -1.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3037 -0.4581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9916 -1.0517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6335 -0.6227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2045 1.0193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7617 3.5243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6322 0.0048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0753 5.9130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9111 2.2256 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 18 19 2 0 0 0 0 M CHG 1 30 -1 M END