MMs03592135 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 34 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 -1.4481 -0.3911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5237 -1.8892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1223 -2.4240 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8194 -1.2564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7801 -2.7086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1180 -2.0302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1994 -0.5324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 0.2870 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5372 0.1460 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7936 -0.6734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7122 -2.1712 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.1315 0.0049 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.3879 -0.8145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3064 -2.3123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5629 -3.1317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9007 -2.4533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9821 -0.9555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7257 -0.1361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3200 -0.2771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5764 -1.0966 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -13.1571 -3.2727 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.4279 1.1211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3822 0.3623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0179 -1.3169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7150 -3.9068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1231 -2.6857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6024 1.3442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1966 1.2032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2362 -2.8550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4977 -4.3299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7909 1.0621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4014 1.2206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 25 1 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 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 28 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 2 0 0 0 0 M CHG 1 21 -1 M END