MMs01746302 MOE2007 2D CORINA 3.40 0006 02.08.2006 21 21 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 0.7902 -1.2750 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4098 -1.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2895 -1.2281 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9789 -2.3872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1328 0.0124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6250 1.4238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5732 -0.4064 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6201 -1.9056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8605 -2.7490 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2086 -2.4135 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7586 0.5128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0812 -2.5968 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 0.6322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6322 1.0200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.6322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8737 -3.5658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4939 -0.4355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7069 1.2481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0233 1.4611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1182 -2.6343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 13 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 0 0 0 0 12 19 1 0 0 0 0 12 20 1 0 0 0 0 13 21 1 0 0 0 0 M END