CHEMBRIDGE-ZINC02922855 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 33 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7030 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0930 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7470 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -3.9650 -0.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.0140 -1.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.4620 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6700 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.0420 -2.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.5190 2.4840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -1.3990 3.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.3330 2.4800 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -1.3750 5.0180 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 0.4110 5.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 0.6780 6.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -0.2440 7.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -3.9060 2.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 -4.3630 3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 -3.6050 2.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7770 -5.6140 3.5280 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 0.8640 4.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 0.8400 4.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 -3.9700 3.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 -4.5430 2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -6.2200 3.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 -5.9080 3.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 1.9420 7.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 2.0630 8.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 18 28 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 29 1 0 0 0 0 21 30 1 0 0 0 0 31 32 1 0 0 0 0 M END