MMs03919223 MOE2007 2D CORINA 3.40 0006 02.08.2006 88 90 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 0.7779 1.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2775 1.2502 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6775 0.2110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9993 -0.0647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0554 2.5327 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8554 2.5327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5586 2.4675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5737 3.5718 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2416 1.1450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6384 0.8915 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7899 0.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8003 1.6815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0513 0.8539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0757 3.0741 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0970 4.1954 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2485 5.0440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5865 5.6182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0648 5.8726 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6731 6.7660 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1874 6.6240 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9874 6.6240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3193 7.8539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1794 9.0828 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8331 7.7288 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1704 6.3929 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3218 7.2414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9971 5.1350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4947 5.2191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3216 3.8029 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7944 5.7956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5677 8.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0144 8.4712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3947 9.9221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8414 10.3183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5691 4.4833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5545 3.3523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2187 1.8904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5053 1.1193 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6112 -0.0761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6363 2.1046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0486 3.4847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9500 4.6837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4390 4.5025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0267 3.1224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1253 1.9235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9493 -0.5759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8340 -1.5789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4077 -1.1145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1449 -3.0463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 0.6223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6223 -1.0260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -0.6223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3407 1.7172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0117 2.4595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9474 -0.6422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5767 -1.1167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0512 0.5127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8848 0.6626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6554 3.2290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1422 7.8705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1584 8.7211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1221 3.7701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3166 6.8964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3064 5.3178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2722 4.6948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9697 8.1240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5121 8.6724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1255 7.2763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2104 8.3731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1379 5.6031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5971 5.1025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6666 1.6553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4799 5.7878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1602 5.4617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2179 2.9775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5954 0.8194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.1271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5846 -1.5940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9855 -2.4274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5935 -0.5440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2667 -0.7429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0361 -2.2555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9710 -3.2951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3937 -4.2203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3189 -2.7976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3282 10.9770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6325 12.1378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 51 1 0 0 0 0 1 52 1 0 0 0 0 1 53 1 0 0 0 0 2 3 1 0 0 0 0 2 54 1 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 56 1 0 0 0 0 5 57 1 0 0 0 0 5 58 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 30 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 59 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 47 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 60 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 36 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 61 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 32 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 62 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 31 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 63 1 0 0 0 0 31 64 1 0 0 0 0 31 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