MMs02167933 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 37 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 -1.3030 -0.7431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 0.0138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5900 1.5138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 2.2569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 3.7569 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.8851 2.2707 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1881 1.5277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4831 2.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7861 1.5415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7941 0.0415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4991 -0.7154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1961 0.0277 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0971 -0.7016 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.3922 0.0554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3842 1.5553 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6952 -0.6877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9902 0.0692 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -14.2932 -0.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5882 0.0830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5802 1.5830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9011 -0.7292 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -0.6055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3094 -1.9431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0504 2.0944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4767 3.4845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8221 2.1470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5055 -1.9154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1035 -1.9015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9287 -1.6111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4714 -1.6028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5268 -1.5972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0694 -1.5890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.8913 -0.6600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -17.9273 -0.0545 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 23 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 7 1 0 0 0 0 6 26 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 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 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 35 36 1 0 0 0 0 M END