CHEMBRIDGE-ZINC02053699 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -0.0490 1.5270 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.0030 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.5100 1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -1.9390 1.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 -2.5520 2.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 -3.9400 2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 -4.5670 3.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6430 -3.8050 4.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5850 -2.4100 4.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9530 -1.7910 3.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3240 -4.4720 5.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 -5.6860 5.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8900 -3.7360 6.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 -4.3450 7.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5810 -6.0540 7.5970 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0790 -3.6090 8.5060 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6260 -4.2360 9.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1120 -3.4680 10.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6520 -4.1040 11.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6870 -5.4920 11.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1850 -6.1920 10.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -5.5580 9.6770 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3540 -6.3390 13.1550 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 1.9050 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 1.8880 -0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 1.8780 0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 -0.3810 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 -0.3530 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -0.1320 1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 -0.1590 2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -4.5280 1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 -5.6450 3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 -1.8180 5.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 -0.7130 3.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8510 -2.7670 6.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 -2.6420 8.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 -2.3900 10.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0380 -3.5330 12.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2100 -7.2720 10.7200 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 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 34 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 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 M END