MMs01314164 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 39 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 -0.7600 -1.2932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0201 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4798 -2.6096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2399 -1.3164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -0.0116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7398 -1.3281 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.7802 -3.8912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0403 -5.1960 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2801 -3.8796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0402 -5.1727 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.5401 -5.1611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4124 -3.9408 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8425 -4.3932 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8541 -5.8932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4312 -6.3678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0745 -6.7654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9292 -8.2584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1496 -9.1306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5151 -8.5099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6603 -7.0170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4400 -6.1447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1251 -6.6938 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.8851 -7.9869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8901 -9.1094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5919 1.0438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -1.2839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0717 -3.6535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 1.0229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0626 -2.6994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4046 -3.4604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8368 -8.7550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0334 -10.3250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5562 -4.9504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8505 -7.2741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6950 -8.8725 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 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 32 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 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 34 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 35 1 0 0 0 0 24 36 1 0 0 0 0 M END