MMs00167968 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 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 -1.2959 -0.7554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 -0.0109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6044 1.4891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3085 2.2445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0063 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9065 2.2336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9128 3.7336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2150 4.4781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2213 5.9781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5109 3.7227 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5526 4.3183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5046 2.2227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2024 1.4782 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8005 1.4673 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.1026 2.2118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3985 1.4563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3922 -0.0436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.7007 2.2009 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.9966 1.4454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2987 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5946 1.4345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5883 -0.0655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2861 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9903 -0.0546 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -16.8842 -0.8209 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.6170 4.4890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3211 5.2445 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0417 -0.5956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2908 -1.9554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6348 -0.6153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3135 3.4445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0304 2.1043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3352 3.1343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8778 3.1278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7057 3.4009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3038 3.3900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6364 2.0302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2811 -2.0100 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 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 26 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 27 28 3 0 0 0 0 M END