MMs01794679 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 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 -0.7405 -1.3045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0189 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5189 -2.5871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2594 -1.2826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7289 -1.5838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8965 -3.0744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5307 -3.6945 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2897 -4.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2712 -3.6745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4783 -2.7840 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3107 -1.2934 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3107 -0.0934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9359 -0.6933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6765 -0.6733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9777 0.7961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6883 -1.7807 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9478 -3.0852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5678 -4.4510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1789 -1.6131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0694 -2.8201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5600 -2.6525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1601 -1.2778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2696 -0.0707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7790 -0.2383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6507 -1.1101 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6076 1.0348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9405 -1.3132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5735 -3.6416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0924 1.0545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6075 -4.6742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1405 -4.5018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0667 0.1340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5997 0.3064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5893 -3.9199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2724 -3.6181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7497 1.0291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0666 0.7273 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 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 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 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 26 39 1 0 0 0 0 M END