MMs01053272 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 -0.7567 -1.2951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0135 -2.5980 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5865 -3.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4865 -2.6058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2432 -1.3107 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2297 -3.9088 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7297 -3.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4864 -2.6214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9864 -2.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7297 -3.9321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9729 -5.2273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4729 -5.2195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7161 -6.5302 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.2296 -3.9399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9864 -2.6448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7702 -3.8932 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2702 -3.8854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1456 -2.6673 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7933 -6.2375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5746 -3.1234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5824 -4.6234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1582 -5.0943 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8853 -5.3666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1804 -4.6099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1726 -3.1099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8697 -2.3666 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0361 -0.6054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6054 1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0361 0.6054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 -0.5190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6800 -2.0617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6243 -4.9449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8918 -1.5791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5918 -1.5931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8675 -6.2556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0225 -3.2502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5918 -1.6087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9503 -2.0394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8915 -6.5666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2227 -5.2044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2087 -2.5045 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 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 17 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 36 1 0 0 0 0 15 16 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 27 2 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 M END