MMs00455839 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 0.7394 1.3051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2393 1.3173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0212 2.5980 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6212 3.6372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5211 2.5858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2817 3.8787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2605 1.2807 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7605 1.2685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6520 2.4748 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0747 1.9996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3798 2.7390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6727 1.9785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6605 0.4785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3554 -0.2609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0625 0.4997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6322 0.0478 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.9534 -0.2820 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.7182 3.9031 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2182 3.9153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9787 2.6224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9576 5.2204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4575 5.2326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1969 6.5377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4364 7.8306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9364 7.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 6.5133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0441 0.5915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5915 -1.0441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0441 -0.5915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3394 0.2659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2491 0.1174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4393 1.3271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2296 2.5173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6521 0.2464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3896 3.9390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7168 2.5700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3457 -1.4608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1098 4.9374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0660 4.1983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3969 6.5475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0279 8.8747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 8.8527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9971 6.5035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 19 1 0 0 0 0 6 7 2 0 0 0 0 6 8 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 17 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 M END