MMs01068584 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 43 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 1.5000 0.0119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2396 1.3169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4793 2.6099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0207 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7603 1.2930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4956 4.0208 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7109 4.9122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6989 6.4121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9314 4.0402 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3543 4.5150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6544 5.9847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0773 6.4596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5317 6.9795 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8266 3.3292 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8957 4.3814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3753 4.1350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2254 5.7233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 5.5005 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.5434 2.0115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2454 0.5414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3696 -0.4516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7917 0.0254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0897 1.4955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9655 2.4886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5118 1.9726 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5917 -1.0440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1082 -1.0225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4395 1.3265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9603 1.2835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5307 3.3281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5538 4.4827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7719 8.1552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3935 6.5996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3491 6.1444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 6.8848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1077 0.1598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1313 -1.6277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6911 -0.7691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2038 3.6647 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 7 19 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 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 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 40 1 0 0 0 0 M END