CHEMDIV-ZINC06728750 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 0.0100 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 1.2060 -0.6840 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0150 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 1.4090 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6600 2.1670 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7940 3.5120 -0.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0850 3.7360 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6910 2.5450 -0.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8640 1.6580 -0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7590 5.0840 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 5.5340 1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6550 6.8440 1.4160 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7060 7.7450 2.8050 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4280 8.9270 2.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3830 7.7570 3.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6880 6.8560 3.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0530 7.0690 4.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8240 6.3730 4.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2290 5.4620 5.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8620 5.2500 5.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0920 5.9510 4.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9820 4.7810 6.6840 F 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 -0.8400 -0.0380 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -1.7640 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.1680 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7130 5.0130 -0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1210 5.8100 -0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0460 5.6050 1.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6380 4.8090 1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0600 7.1840 0.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5160 7.7780 3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8900 6.5380 4.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3970 4.5400 6.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0250 5.7890 4.7840 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 M END