MMs03184715 MOE2007 2D CORINA 3.40 0006 02.08.2006 62 63 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 -0.4285 -1.4375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3161 -3.2227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2854 -4.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9183 -0.6954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3774 -1.0431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4081 0.0468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8673 -0.3009 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.5567 0.8582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2957 -1.7384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8980 0.7889 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.3571 0.4412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7856 -0.9963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.3878 1.5310 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.3485 2.1310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1119 3.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4289 3.7234 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -12.5187 2.6928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8753 1.3378 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.5933 0.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8117 -1.2595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.0928 -0.0159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.8744 1.2644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.3739 1.2276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.0919 -0.0894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.3103 -1.3697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.8108 -1.3329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.5915 -0.1261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -19.3094 -1.4431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -0.3428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3428 1.1500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 0.3428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7636 -1.5754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3573 -2.6354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0315 -4.1861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3891 -2.6854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1573 -5.1370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4609 -5.1844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4136 -3.4880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3949 0.4059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9165 -0.0347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9008 -2.1443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3792 -1.7037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4063 0.7074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8847 1.1481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4457 -1.3956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6385 -2.8884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1457 -2.0812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5552 1.9389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9619 2.6627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6508 4.1133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2476 3.6460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5430 2.0675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3000 2.3180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.9992 2.2519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.8847 -2.4233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1855 -2.3572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.3630 -0.8687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.8838 -2.4967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.2558 -2.0175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8876 -1.7852 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0391 -2.6337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 61 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 61 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 5 61 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 7 45 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 10 46 1 0 0 0 0 10 47 1 0 0 0 0 10 48 1 0 0 0 0 11 12 1 0 0 0 0 11 49 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 61 62 1 0 0 0 0 M CHG 1 61 1 M END