MMs02265673 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 51 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 -1.2999 -0.7485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 0.0030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5963 1.5030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2964 2.2515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0018 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2946 3.7515 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.8980 -0.7454 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8998 -2.2454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1997 -2.9939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2014 -4.4939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9033 -5.2454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6034 -4.4969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6016 -2.9969 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4978 -2.2424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4961 -0.7424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7977 -2.9909 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0959 -2.2393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3958 -2.9878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6940 -2.2363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6922 -0.7363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3923 0.0122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0941 -0.7393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9904 0.0152 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -12.2388 1.3134 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.7419 -1.2829 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.2885 0.7668 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.5884 0.0183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.9580 0.6300 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -17.9631 -0.4835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.2146 -1.7834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7470 -1.4733 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0385 -0.6012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3013 -1.9485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6348 2.1043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0417 2.0988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9365 -0.1442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2414 -5.0927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9047 -6.4454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5648 -5.0982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7992 -4.1908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3972 -4.1878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7339 -2.8351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3909 1.2122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0542 -0.1405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2871 1.9668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.1563 -0.3567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.7039 -2.8791 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 30 47 1 0 0 0 0 31 32 1 0 0 0 0 31 48 1 0 0 0 0 M END