MMs01626678 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 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 -0.7444 1.3023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2444 1.3087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 0.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2556 -1.2893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7556 -1.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2555 -1.2764 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8555 -2.3157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5111 -2.5787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0112 -2.5851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7555 -1.2700 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4999 0.0323 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.1977 0.7767 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8022 -0.7121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2443 1.3346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4887 2.6303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2331 3.9326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7331 3.9391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4887 2.6433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7443 1.3410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9887 2.6497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7443 1.3539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4775 5.2413 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.0052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1399 2.3389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8399 2.3505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5578 -1.8077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1601 -2.3376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2865 1.2002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6258 0.4347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3600 -2.3066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2888 2.6252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6287 4.9692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3488 0.3044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2667 -3.8745 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.7331 3.9520 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.9331 3.9571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6712 -4.9163 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 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 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 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 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 36 39 1 0 0 0 0 37 38 1 0 0 0 0 M END