MMs01952330 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 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 0.2251 -1.4830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8423 -2.5368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3397 -2.4487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1648 -3.7014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4924 -5.0423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 -5.1304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -3.8777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -3.6526 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1561 -4.5065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5572 -2.1726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8981 -1.5002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9862 -0.0028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1508 -2.3252 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0627 -3.8226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4917 -1.6529 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4917 -2.8529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7358 -0.1729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2189 0.0523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8912 -1.2886 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.3040 -0.7846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9995 -2.2994 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8238 -2.3424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6622 -3.6133 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.1864 0.1801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1801 1.1864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1864 -0.1801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8776 -1.3760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1524 -6.0445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4571 -6.2031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8647 -3.7521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9922 -5.0206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2606 -3.8931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5379 -0.1024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6807 1.0259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9157 1.2133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3419 0.4751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1637 -3.3446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7515 -3.1036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 11 2 0 0 0 0 3 4 1 0 0 0 0 3 8 2 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 24 1 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 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 15 1 0 0 0 0 14 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 23 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M END