MMs01725470 MOE2007 2D CORINA 3.40 0006 02.08.2006 38 40 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 0.7576 1.2946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0152 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4848 2.6068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2424 1.3122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 0.0088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2271 3.9102 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0271 3.9102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7271 3.9190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4847 2.6244 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4695 5.2224 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9695 5.2312 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3695 6.2704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0239 6.2981 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1754 7.1466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0907 5.2436 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0363 4.1768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0451 2.6768 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5373 5.6404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9171 7.0915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8502 8.1459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4036 7.7492 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -11.3637 7.4882 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -10.6042 4.5859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2245 3.1348 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5939 -1.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9576 1.2876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6213 3.6337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4423 1.3192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1061 -1.0269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8634 6.2581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8291 8.8400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3367 9.2305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2696 5.1978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0508 4.9826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4695 5.2049 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0634 6.2476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9043 4.1391 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 19 20 2 0 0 0 0 19 24 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 21 32 1 0 0 0 0 21 33 1 0 0 0 0 24 25 2 0 0 0 0 24 35 1 0 0 0 0 34 36 1 0 0 0 0 35 38 1 0 0 0 0 36 37 1 0 0 0 0 M END