MMs03706956 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.2932 -0.7600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8912 -0.7801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2076 1.4598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5124 2.1998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8056 1.4398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4892 -0.8001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2170 -0.5347 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.1080 0.6720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2357 1.8923 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6079 0.6604 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3679 1.9536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6280 3.2584 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8679 1.9421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6078 0.6373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1078 0.6257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8678 1.9189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1279 3.2237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6279 3.2353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8879 4.5401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6480 5.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8478 -0.6791 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 1.0346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0346 0.6080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 -1.0346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5148 -1.6733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0574 -1.6852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8338 0.9051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3764 0.8932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1128 -1.6933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6554 -1.7052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1730 2.0679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5216 3.3998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4799 -2.0001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1999 -0.3834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9998 -0.3973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0678 1.9096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7359 4.2583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6825 5.2253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2560 6.8678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6134 6.4413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M END