MMs03955290 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 1.4999 -0.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2391 -1.3177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7391 -1.3302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 -0.0375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 -0.0500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7389 -1.3552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9782 -2.6479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4782 -2.6355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7174 -3.9282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4566 -5.2334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6958 -6.5262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2389 -1.3677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 -0.0749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2605 1.2303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5214 2.5355 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4996 -0.0874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3914 1.1187 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0301 2.2630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8141 0.6433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1193 1.3825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4120 0.6217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3996 -0.8783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0943 -1.6174 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8016 -0.8566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3712 -1.3083 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.7173 1.3608 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3014 1.1710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6310 0.3885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9085 1.0067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6084 0.9842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5695 -3.6921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3822 -4.4698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3694 -6.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6616 -5.9176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0872 -7.5604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7300 -7.1348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8302 -2.4119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1293 2.5824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4338 -1.4869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 35 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 36 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 3 0 0 0 0 17 18 1 0 0 0 0 17 26 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 M END