MMs01526081 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 41 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 1.4999 -0.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2387 -1.3184 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0387 -1.3184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4775 -2.6109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7386 -1.3314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 -0.0388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 -0.0518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7385 -1.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9774 -2.6498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4774 -2.6368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2385 -1.3702 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9772 -2.6757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2161 -3.9682 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4772 -2.6886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2159 -3.9941 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.7159 -4.0070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5871 -5.2281 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.0074 -2.5800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0176 -4.7769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0305 -3.2770 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.6080 -2.8011 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.2235 -5.6690 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0104 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0104 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3018 1.1706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6311 0.3877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4435 -2.0020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8686 -3.6449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5115 -3.2199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9088 1.0055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6087 0.9822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5684 -3.6941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8685 -3.6708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8474 -0.3362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2790 -1.5051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6083 -2.2879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0877 -6.8613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3239 -5.1904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 20 2 0 0 0 0 19 21 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 M END