CHEMBRIDGE-ZINC00049305 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 0 0 0 0 0 0999 V2000 0.0460 1.5250 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 -0.7600 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7170 -1.2050 -2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 -1.3840 -3.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -1.1100 -3.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6700 -2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 -1.8600 -4.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8950 -1.2750 -5.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5350 -1.7920 -6.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5820 -1.3190 -6.7540 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9380 -2.8030 -7.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3490 -3.1540 -7.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7820 -3.3280 -6.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 -4.6090 -7.4640 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 -2.8860 -5.4710 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -3.2990 -5.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4840 -0.2040 -4.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9520 0.6460 -3.8010 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 1.8580 0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 1.9290 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 1.8760 0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -0.4080 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -0.3380 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 -0.6200 -0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7760 -1.4150 -2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -1.2460 -4.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -0.4620 -2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 19 20 3 0 0 0 0 M END