MMs02589947 MOE2007 2D CORINA 3.40 0006 02.08.2006 38 41 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 -0.7564 1.2953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0127 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4872 2.6054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2436 1.3101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7436 1.3174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4872 2.6201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0221 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0294 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8875 -1.1797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4310 -2.6086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3118 -0.7092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5297 -1.5849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8970 -0.9681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2017 0.5006 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3943 1.3884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6926 0.6647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5684 1.8826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0609 1.7331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6777 0.3658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8020 -0.8521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3095 -0.7026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1997 -1.7117 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3045 0.7908 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.8756 1.2473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4051 2.6716 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2309 3.9081 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5949 -1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9563 1.2895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6178 3.6343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1051 -1.0289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9051 -1.0201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4101 -2.7790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0749 2.9764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7615 2.7074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8717 0.2462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2955 -1.9459 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 1 0 0 0 0 16 18 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 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 M END