MMs00947766 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 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 0.9805 -1.1352 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1786 -1.4458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6384 -2.5957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9216 -3.3723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2031 -4.8457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6199 -5.3386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7551 -4.3581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4736 -2.8848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0568 -2.3919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4752 -1.0092 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2518 0.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5288 1.5883 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7515 0.2431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6088 -1.9043 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6283 -0.7691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5892 -3.0395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7440 -0.9238 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1607 -1.4167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2959 -0.4362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0144 1.0371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1496 2.0176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5663 1.5247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8478 0.0513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7126 -0.9291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2645 -0.4416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3997 0.5389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9014 -6.8119 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.9082 0.7844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7844 0.9082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9082 -0.7844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 -2.2014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1277 -3.6816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2950 -5.6301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8884 -4.7524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7391 -0.3568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9513 0.2183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7763 1.4428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5188 0.2548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5755 -2.4644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0908 -2.1749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8810 1.4314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9244 3.1962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4745 2.3090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9378 -2.1078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1841 -0.3693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3079 1.3233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6153 1.4471 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 4 1 0 0 0 0 2 11 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 M END