MMs01981143 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 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 1.2944 -0.7580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8924 -0.7741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8831 -2.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5795 -3.0160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2851 -2.2580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5702 -4.5160 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5310 -3.9160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8646 -5.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8553 -6.7740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5517 -7.5159 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2573 -6.7579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2666 -5.2579 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1571 -4.7856 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0463 -5.9936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1721 -7.2126 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5463 -5.9844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4354 -7.1924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8591 -6.7201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8498 -5.2201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4204 -4.7654 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1497 -7.5320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1682 -4.5320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1775 -3.0321 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4626 -5.2900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6064 1.0355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0355 0.6064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6064 -1.0355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6054 1.1839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9353 -0.1805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4009 -2.5773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2422 -2.8516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5443 -8.7159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0717 -8.3360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8343 -7.4194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8163 -4.5088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5433 -8.5675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1852 -8.1384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7561 -6.4965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4552 -6.4900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5055 -4.6965 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 17 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M END