CHEMDIV-ZINC06800370 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 0.7160 1.2260 0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -0.0470 0.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -1.1180 1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -2.3490 1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 -2.6840 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -1.9500 -1.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -0.5620 -1.2010 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -0.8270 -1.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 0.4420 -1.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -3.9400 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 -4.5650 -0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0010 -5.7700 -0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 -5.8120 0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6730 -4.7100 1.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -0.9090 2.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 -1.5900 2.9160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 0.0480 3.4270 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 0.3860 4.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -0.6870 5.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7280 -1.6880 7.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 -1.4380 9.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 -0.2710 9.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 0.8990 9.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 0.7770 7.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 1.0360 0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 1.8750 -0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 1.7840 1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -3.1520 1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8010 -4.1900 -1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6540 -6.5170 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4730 -6.5200 1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 0.5290 3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1200 0.5390 4.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 1.3410 5.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 -0.7010 6.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -1.6800 5.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 -2.5440 7.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -1.8320 8.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -2.2870 9.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 -1.3260 8.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 1.7530 9.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 1.0650 8.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 0.6490 8.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 1.6460 7.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -0.4630 7.0040 N 0 3 0 0 0 0 0 0 0 0 0 0 2.6810 -0.3540 6.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 3 4 2 0 0 0 0 3 15 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 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 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END