MMs01459116 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 1.4136 -0.5018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6859 -1.9768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0994 -2.4786 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7697 -1.1367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0781 0.1943 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2531 -1.3595 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4996 -2.8391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8415 -3.5094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1685 -3.5307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3052 -0.2904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7572 -0.6670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1570 -2.1128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8093 0.4021 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2613 0.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3134 1.0945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7654 0.7179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8175 1.7870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2695 1.4103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6693 -0.0354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6171 -1.1045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1652 -0.7279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1212 -0.4121 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.9928 -3.4912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5625 -3.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5441 -4.0516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2205 -5.5163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2097 -5.9684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3164 -4.9558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4014 1.1309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1309 0.4014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4014 -1.1309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6125 0.6816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6136 -0.4922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0859 -1.9816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4869 -3.1602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9903 -4.7174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3168 0.3900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8037 0.8012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4895 1.5586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7629 -1.0662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2497 -0.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3250 1.7749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8119 2.1861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4977 2.9436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1112 2.2656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9370 -2.2611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3235 -1.5832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4331 -2.4532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6883 -3.6899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1059 -6.3264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4686 -7.1402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4606 -5.3175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 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 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 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 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 48 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 M END