MMs02560975 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 36 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 -1.5000 0.0057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2451 1.3075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4902 2.6037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0098 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7549 1.2962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7647 3.8942 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.7451 1.3132 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6313 0.1030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1732 -1.3253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0561 0.5720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2730 -0.3051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6978 0.1638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3027 1.5364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7939 1.6989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6802 0.4887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0753 -0.8839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5841 -1.0464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7070 -2.2632 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2787 -1.8051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0685 -2.6914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3988 3.0715 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -6.0505 2.0719 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6221 2.5301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1532 3.9549 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5961 -1.0415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1039 -1.0313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0862 3.6452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9549 1.2916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5937 2.5046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8731 0.6186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7843 -1.8521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0821 -3.4031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 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 7 1 0 0 0 0 6 29 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 20 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 30 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 M END