MMs01760871 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 -0.7558 1.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0116 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4884 2.6047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2442 1.3091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7442 1.3157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6204 2.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0491 2.0760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0558 0.5760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6313 0.1062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2732 -0.3002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6408 0.3160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9432 -0.4282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1066 -1.9193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0534 0.5805 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4372 1.9480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1814 3.2504 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9461 1.7846 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.5220 0.2751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5207 1.3943 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.1207 0.3551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2023 2.8601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4980 3.6159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6172 2.6172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0132 1.2442 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2326 3.9071 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5954 -1.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9558 1.2903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6162 3.6346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1046 -1.0299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2445 3.6728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0167 2.7857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1531 -1.4942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0774 -0.8395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5425 -0.3562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0627 2.4842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7093 3.9542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7883 4.5836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3862 4.4228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3182 3.5912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6590 2.0218 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END