MMs00698091 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 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 -1.4112 0.5086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3309 -0.6763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4882 -1.9172 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0476 -1.4992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8302 -0.6287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5385 0.6935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0246 0.8975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0632 -0.1847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2897 2.3739 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9675 3.0823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7635 4.5684 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8852 2.0437 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.6400 3.0272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8809 2.1845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2311 2.8378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4720 1.9951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3627 0.4991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.8223 2.6484 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.0632 1.8057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.4135 2.4590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.6544 1.6163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5450 0.1203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1948 -0.5330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9539 0.3097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.7859 -0.7224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.1362 -0.0691 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9927 0.6742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7456 1.6610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9003 -2.2351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4628 -1.6484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9377 4.0003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4763 3.8878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0446 1.3239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5832 1.2115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5289 3.8109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0674 3.6984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9098 3.8452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5009 3.6558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.7346 2.1389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1073 -1.7298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8736 -0.2129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.6766 -2.2184 0.0000 O 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 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 30 1 0 0 0 0 6 7 2 0 0 0 0 6 31 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 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 2 0 0 0 0 M CHG 1 27 -1 M END