MMs01671449 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 37 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 -1.3039 0.7415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 -0.0170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5882 -1.5169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2843 -2.2584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0098 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3137 -2.2415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3235 -3.7414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6078 -1.4830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9117 -2.2245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2058 -1.4660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5098 -2.2075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8039 -1.4490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1078 -2.1905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4019 -1.4321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 0.0679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0882 0.8094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6862 0.8264 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.9277 2.1205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4447 -0.4677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9803 1.5848 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 14.0234 0.9916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9019 0.7245 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0353 0.6068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3118 1.9415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6235 -2.1237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2765 -3.4584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1464 -3.1488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6891 -3.1387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4285 -0.5518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9712 -0.5417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1156 -3.3905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4450 -2.0253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0803 2.0094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7509 0.6441 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 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 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 M CHG 1 22 -1 M END