MMs01459693 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 0.8471 -1.2379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1987 -2.5905 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9118 -3.9101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1229 -4.9961 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4755 -4.3477 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2767 -2.8609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3627 -1.8262 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8018 -2.2493 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9609 -2.5599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1549 -3.7072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8878 -1.2146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5347 0.2432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3269 -1.6378 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4129 -0.6031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0598 0.8548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1458 1.8895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5849 1.4663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9380 0.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8520 -1.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2051 -2.4841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5581 -3.9419 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3986 -4.1089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1117 -5.4285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5871 -5.1581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7858 -3.6713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4333 -3.0229 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9903 0.6777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6777 0.9903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9903 -0.6777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7047 -0.3985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8227 -1.9367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3212 -3.4247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4374 -4.8735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9886 -3.9896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6094 -2.8041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9086 1.1933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8634 3.0557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4537 2.2941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0892 -0.3301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5929 -6.5106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4559 -5.9859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8416 -3.1009 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 7 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 21 22 3 0 0 0 0 23 24 2 0 0 0 0 23 27 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 M END