MMs02591929 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 54 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 1.2953 -0.7564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8934 -0.7692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4914 -0.7819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0895 -0.7947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3996 1.4489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 2.2052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8015 1.4616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5062 2.2180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5136 3.7180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7023 2.1925 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6875 -0.8075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8370 -2.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3026 -2.6191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0590 -1.3238 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.2530 -1.2042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0608 -0.2041 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7173 -3.2982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2930 -2.8277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1734 -3.8259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4780 -5.2946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9023 -5.7652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0220 -4.7670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3584 -6.2928 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.6051 1.0363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0363 0.6051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6051 -1.0363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5195 -1.6718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0621 -1.6794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8312 0.9103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3739 0.9027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1175 -1.6846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6602 -1.6922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4293 0.8975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9719 0.8899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7156 -1.6974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2582 -1.7050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0865 -1.3947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1101 3.4052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7135 3.7121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5195 4.9180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3136 3.7239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7082 3.3924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7853 -3.7178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1712 -2.2402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0340 -3.4495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1460 -6.9402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1614 -5.1434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 M END