MMs01959609 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 43 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 0.7455 1.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0091 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5091 2.5928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2545 1.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -0.0052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2636 3.8892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6583 5.2617 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7765 6.2615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0729 5.5069 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7559 4.0408 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3746 6.2524 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4138 6.8524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3798 7.7524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0834 8.5069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0887 10.0069 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7818 7.7614 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6710 5.4978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6658 3.9978 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9727 6.2433 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.2691 5.4887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2638 3.9887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5602 3.2342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8619 3.9797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8671 5.4796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5707 6.2342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1688 6.2251 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6036 -1.0371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9454 1.3059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5873 3.6394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4545 1.2870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0964 -1.0466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5609 7.5398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7942 8.8785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7447 8.3651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9769 7.4433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2225 3.3924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5560 2.0342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8990 3.3760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5749 7.4342 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 40 1 0 0 0 0 M END