MMs01118528 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 1.3301 0.6935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5957 -0.1117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9257 0.5818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1914 -0.2233 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2839 -1.7205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2332 -2.7910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 -4.2362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0874 -4.6109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1381 -3.5403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7363 -2.0951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5415 -0.8295 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5866 0.3273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9613 1.7798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7467 0.0635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1227 -0.5338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2934 -2.0240 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3279 0.3592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3138 1.8592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7360 2.3360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6290 1.1308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7587 -0.0909 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.1290 1.1449 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.8958 -1.4744 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5548 1.0641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0641 -0.5548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5548 -1.0641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 1.6450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1402 1.5787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7855 -0.9969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3268 -1.0632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1946 1.5334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7359 1.4671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0712 -2.4913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7944 -5.0927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4089 -5.7670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3001 -3.8400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8757 0.8889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4084 1.0646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3365 2.5554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0961 3.4807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9907 -2.6707 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 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 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 12 24 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 24 42 1 0 0 0 0 M END