MMs01183833 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 1.3288 0.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5468 2.1800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0256 2.4313 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5583 3.5066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7215 1.1025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6729 0.0300 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4743 3.2287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8462 4.6819 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2263 5.7305 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0749 6.5791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1456 7.1837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6708 5.3261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0427 3.8729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4871 3.4684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5596 4.5171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1877 5.9703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7433 6.3747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2906 5.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3631 4.0377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6625 6.5395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0568 7.0928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9615 8.5897 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5083 8.9617 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7055 7.6945 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5568 1.0630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -0.5568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5568 -1.0630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9088 0.9281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2029 2.2381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6189 3.7236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3081 6.8862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4431 8.3462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0169 7.4812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1847 3.0340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7847 2.3059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7152 4.1935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0457 6.8092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4457 7.5373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0705 6.4505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 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 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 M END