MMs01158768 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 48 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 1.3942 0.5534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7659 2.0066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2629 2.1021 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8163 0.7080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6614 -0.2492 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2695 0.3362 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3180 1.4089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9134 2.8533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7713 1.0371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8198 2.1098 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4151 3.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4637 4.6268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0590 6.0712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6058 6.4429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1075 7.1438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2730 1.7380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3215 2.8107 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6777 0.2936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6291 -0.7790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0338 -2.2234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4870 -2.5951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5355 -1.5225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1309 -0.0781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1794 0.9945 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.4427 1.1153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1153 -0.4427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4427 -1.1153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0002 2.9306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5932 -0.8193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2765 -0.0561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7620 0.3601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3334 3.0347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7157 4.5293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1631 3.6517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5454 5.1463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7484 7.2303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9032 7.6055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4432 6.7403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3084 5.2804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9657 6.3050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9464 8.0019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2494 7.9827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4666 -0.4816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1950 -3.0815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8107 -3.7506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6981 -1.8199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 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 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 M END