MMs03123944 MOE2007 2D CORINA 3.40 0006 02.08.2006 29 30 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 -0.8950 -1.2037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3849 -1.0305 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4009 -2.1341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1052 -3.6047 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7644 -1.5090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0716 -2.2446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3623 -1.4804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3458 0.0195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6365 0.7838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9437 0.0481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9602 -1.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6695 -2.2160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2674 -2.1874 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -11.2344 0.8124 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5912 -0.0190 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1206 0.2767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4955 1.6402 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -0.7160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 0.9630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 0.7160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1777 -1.7416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2384 -2.3535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0848 -3.4446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3000 0.6080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6233 1.9837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6827 -3.4160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2212 2.0123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4741 0.7937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 26 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 14 1 0 0 0 0 13 27 1 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 M END