MMs00682652 MOE2007 2D CORINA 3.40 0006 02.08.2006 37 38 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 0.7561 -1.2955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2561 -1.2885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0121 -2.5840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2682 -3.8865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7682 -3.8936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0122 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4878 -2.6051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0243 -5.1821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5121 -2.5770 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2560 -1.2744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0211 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7560 -1.2674 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 0.0351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7438 1.3306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7560 -1.2534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2560 -1.2464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9999 0.0562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2438 1.3517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7438 1.3447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9877 2.6402 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 12.0120 -2.5419 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0364 0.6049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6049 1.0364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0364 -0.6049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8512 -0.2465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1731 -4.9356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4934 -1.4051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6878 -2.6107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4822 -3.8051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4292 -6.2241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 -3.6134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3609 -2.3038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1608 -2.2954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1999 0.0618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8389 2.3937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 16 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 35 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 M END