MMs02743994 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 62 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 1.4183 0.4882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5503 -0.4960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9686 -0.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 1.4646 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 2.4488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7047 1.9606 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4094 3.9212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1006 -0.9920 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5189 -0.5038 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0307 0.9145 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0071 -1.9221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9372 -0.0156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0692 -0.9998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4875 -0.5116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7739 0.9608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6419 1.9450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2236 1.4568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1922 1.4490 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3242 0.4648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0378 -1.0076 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7425 0.9530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8745 -0.0312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2928 0.4570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5792 1.9294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9975 2.4176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1295 1.4334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8431 -0.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4248 -0.5272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1384 -1.9996 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 21.5478 1.9216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.6798 0.9374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.0981 1.4256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.3845 2.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2525 3.8822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8342 3.3940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3906 1.1347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1347 -0.3906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3906 -1.1347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3212 -1.6739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5873 3.6921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6385 5.0992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2315 4.1503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8715 -2.1699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8401 -2.1777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3931 -1.2990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8710 3.1229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3180 2.2442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4213 2.6269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1609 2.0026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6752 1.7081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6736 2.7168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2266 3.5955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7487 -0.8264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.4507 -0.2405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.0037 0.6382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.5191 3.2886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.4816 5.0601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.9286 4.1814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 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 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 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 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 55 1 0 0 0 0 33 34 1 0 0 0 0 33 56 1 0 0 0 0 34 35 2 0 0 0 0 34 57 1 0 0 0 0 35 36 1 0 0 0 0 35 58 1 0 0 0 0 36 59 1 0 0 0 0 M END