MMs01525971 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 48 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 1.2957 0.7557 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2891 2.2557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0115 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3423 1.3138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8538 -1.2909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9004 -0.7328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -2.2328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2093 -2.9771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5050 -2.2214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4984 -0.7214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7875 1.5343 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0965 -0.7099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6945 -0.6985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7011 -2.1985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0573 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2926 -0.6870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2992 -2.1870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6015 -2.9313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8972 -2.1756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8906 -0.6756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 0.0687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1864 0.0802 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 18.1996 -2.9198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.2062 -4.4198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6046 1.0366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0366 -0.6046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6046 -1.0366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4891 2.2610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2838 3.4557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0891 2.2504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8704 -2.8374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2146 -4.1771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5469 -2.8168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1908 1.2229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6168 0.9616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1595 0.9684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9850 1.2572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2626 -2.7916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6068 -4.1313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5830 1.2687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0062 -4.4251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2115 -5.6198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4062 -4.4145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 38 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 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 44 1 0 0 0 0 27 28 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 M END