MMs01690845 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 48 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 1.3054 0.7388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9034 0.7166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9162 2.2165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2217 2.9554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5142 2.1943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5014 0.6943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9239 0.2186 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2850 -0.9258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8160 1.4245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9447 2.6456 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3159 1.4117 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.0770 2.7042 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6770 1.6650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3382 4.0097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0993 5.3022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3604 6.6076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8605 6.6205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0994 5.3279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8382 4.0225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5770 2.6914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3381 3.9840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3158 1.3860 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.8158 1.3731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5547 0.0934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5911 1.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0443 -0.5911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5911 -1.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 1.6647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0846 1.6515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8822 2.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2319 4.1553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1857 -1.2445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2992 5.2919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9693 7.6417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2694 7.6648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8994 5.3382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5338 3.5055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8055 0.1732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0157 1.3628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8260 2.5731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5207 0.7023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9458 -0.9406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5888 -0.5155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 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 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 M END