MMs01341641 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 54 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 1.5000 -0.0088 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2575 1.2859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5151 2.5893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2727 3.8839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7727 3.8751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5151 2.5718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7575 1.2771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0263 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0350 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9911 -1.5350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0087 1.4649 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 -0.0438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2574 1.2508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7574 1.2421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4998 -0.0613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7422 -1.3560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2423 -1.3472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7394 -2.4765 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1133 -1.8744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9652 -0.3818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4079 -2.6320 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.7113 -1.8896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0059 -2.6472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9972 -4.1472 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3093 -1.9048 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.6040 -2.6623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5952 -4.1623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8898 -4.9199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1932 -4.1775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2020 -2.6775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9074 -1.9199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9161 -0.4200 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 22.4879 -4.9351 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 19.8811 -6.4199 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3152 2.5963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6788 4.9266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3788 4.9109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7151 2.5647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8939 -1.0620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6635 2.2935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3635 2.2778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6362 -2.3829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9453 -0.9659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4880 -0.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3163 -0.7048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5525 -4.7562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.2447 -2.0836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 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 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 7 2 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 35 1 0 0 0 0 30 31 2 0 0 0 0 30 34 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 M END