MMs02594195 MOE2007 2D CORINA 3.40 0006 02.08.2006 28 29 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 -1.4696 0.3002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2093 -1.0047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1968 -2.1114 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1686 -1.4905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6998 -1.1733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5911 0.0332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0910 0.0213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9631 -1.1992 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5659 1.4442 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3594 2.3354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3712 3.8354 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.1389 1.4634 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.9961 1.8964 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.1552 2.2070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3196 3.3611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7498 3.8133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1028 0.8839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7793 -0.5808 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8854 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9664 1.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2126 -2.0822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1792 -2.2734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1207 3.4125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1620 4.5507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0086 4.9850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5330 1.3361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4184 0.5261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 22 1 0 0 0 0 6 7 2 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 18 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 16 25 1 0 0 0 0 17 26 1 0 0 0 0 18 19 2 0 0 0 0 18 27 1 0 0 0 0 27 28 1 0 0 0 0 M END