MMs01475087 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 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 0.7610 1.2926 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0221 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4779 2.6107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2168 3.9161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4558 5.2087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0441 5.1960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7831 3.8906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 3.8779 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0440 5.1705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1948 6.5141 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.6947 6.5268 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4338 7.8067 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.7168 3.9288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4557 5.2342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4778 2.6362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9777 2.6489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7387 1.3563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2387 1.3690 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9997 0.0764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2607 -1.2290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0217 -2.5216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5217 -2.5089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2606 -1.2035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4996 0.0891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2386 1.3945 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0341 0.6088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6088 -1.0341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0341 -0.6088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0867 1.5766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6529 6.2301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0781 4.5617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6528 6.2046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0099 5.7793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7593 3.8289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1018 3.0689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6146 0.9363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9571 0.1763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0608 -1.2392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4306 -3.5659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1305 -3.5430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4606 -1.1933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 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 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 M CHG 1 11 1 M CHG 1 13 -1 M END