MMs00039739 MOE2007 2D CORINA 3.40 0006 02.08.2006 29 31 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 -1.2931 0.7602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 0.0205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6099 -1.4794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3168 -2.2397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0119 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2812 -2.2602 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.7895 -2.4059 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2496 -2.0620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1936 -3.2277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8893 -0.7053 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.7379 -1.5539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3742 -0.4926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6307 0.9853 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.6307 2.1853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3038 1.6872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2276 0.6423 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7628 0.9656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4177 2.4254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9771 1.6465 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0439 0.5918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2836 1.9602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3263 -3.4396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5309 -3.5777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4193 -1.6918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5715 -0.5731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9725 2.6836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3826 2.4562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9738 0.9781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 20 29 1 0 0 0 0 M END