MMs01698194 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 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 1.3032 -0.7428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3115 -2.2428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6146 -2.9856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9095 -2.2284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9012 -0.7284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2127 -2.9712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5076 -2.2140 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8107 -2.9568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8190 -4.4568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1056 -2.1996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0973 -0.6996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 0.0576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6953 -0.6852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7036 -2.1852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4088 -2.9424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0068 -2.9280 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.7496 -1.6248 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2640 -4.2312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3100 -3.6708 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3183 -5.1708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 0.0719 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5942 1.0425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0425 0.5942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5942 -1.0425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2756 -2.8485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6213 -4.1855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9371 -0.1227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5914 1.2144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4464 -3.8947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9891 -3.8861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5009 -1.0140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0547 -0.1054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3855 1.2575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4154 -4.1424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3459 -3.0651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1183 -5.1774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3249 -6.3708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5183 -5.1641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 M END