MMs00271785 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 -1.4999 0.0131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2386 1.3186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4773 2.6111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0227 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7613 1.2924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2159 3.9166 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7159 3.9297 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1159 4.9689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5869 5.1508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1110 6.5733 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0175 4.6998 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0306 3.1998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2518 2.3288 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6081 2.7239 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.2233 5.5920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5989 4.9939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7687 3.5035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5909 -1.0444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 -1.0209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4385 1.3291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6317 3.6319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9613 1.2820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6069 4.9505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3529 6.4180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8856 6.5926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8047 5.8861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.9051 5.4076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 16 26 1 0 0 0 0 17 18 2 0 0 0 0 17 27 1 0 0 0 0 27 28 1 0 0 0 0 M END