MMs01028889 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 40 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 0.7408 -1.3043 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3408 -2.3435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0183 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5182 -2.5875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2774 -3.8812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2408 -1.3148 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2591 1.2832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2407 -1.3359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7407 -1.3465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 -0.0528 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7590 1.2515 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.0633 1.9924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7695 2.7515 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2590 1.2621 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5182 2.5664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4815 -2.6508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9722 -2.8181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2737 -4.2874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9694 -5.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8618 -4.0168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0434 0.5927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5927 1.0434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0434 -0.5927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1064 -3.0164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 -3.7783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3123 -3.2739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8847 -4.9162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2424 -4.4885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8335 -2.3583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6334 -2.3709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5616 3.1590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9255 3.6098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4747 1.9737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7814 -1.9320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3665 -4.7832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8356 -6.2208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 M END