MMs03581076 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 0.0075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2435 1.3103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 2.6055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2305 3.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7305 3.9158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4870 2.6205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7435 1.3177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 0.0225 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0999 -1.0168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7564 -1.2803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2655 -1.4445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9609 -2.9133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2637 -3.6568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3734 -2.6476 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4279 -5.1478 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 6.7564 -1.2653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2564 -1.2579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2434 1.3402 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4434 1.3402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7434 1.3327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9869 2.6430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4869 2.6504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 2.5995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6253 4.9445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3253 4.9580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6870 2.6265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4581 -0.5568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8671 -3.4069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9707 -2.4461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6308 -1.6814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0539 -2.4406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3860 -1.6626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9230 -0.7218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9153 0.8208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9459 2.5155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6138 1.7375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0299 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2304 3.9382 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8253 4.9804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 42 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 43 44 1 0 0 0 0 M END