MMs02820742 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 53 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 1.5000 0.0079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2568 -1.2871 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7568 -1.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5137 -2.5742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0063 -2.7231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3259 -4.1887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0308 -4.9456 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9108 -3.9478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4453 -4.2674 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9893 -5.6964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9989 -6.8058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5238 -6.0160 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1238 -7.0553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0678 -7.4450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4858 -4.9066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9514 -5.2263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4073 -6.6553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8729 -6.9749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8825 -5.8655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4265 -4.4365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9610 -4.1169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4361 -3.3271 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 7.0041 -1.6031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5330 -0.1790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5308 0.9410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9996 0.6369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4707 -0.7872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4729 -1.9072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9395 -1.0913 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 11.4106 -2.5154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9373 0.0287 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0063 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0063 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2854 1.1886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6254 0.4243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4247 -4.6710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6376 -3.3799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0754 -7.0803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -8.5883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -7.8098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5997 -7.5428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2377 -8.1181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0549 -6.1212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5962 -2.9737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3579 0.0643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1539 2.0803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7979 1.5329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8498 -3.0465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 8 2 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 40 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 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 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 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 47 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 30 51 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 M CHG 1 31 1 M CHG 1 33 -1 M END