CHEMBRIDGE-ZINC04996979 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 40 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.0910 2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 3.0240 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 3.4550 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 4.9800 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8020 5.4120 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8080 7.3280 -2.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9100 8.8540 -2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8300 9.3250 -3.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9280 10.7870 -3.2250 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6910 11.4280 -4.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2970 10.7940 -4.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7890 12.9010 -4.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5200 13.5160 -4.9750 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2270 12.7780 -5.9550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 1.5250 2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 0.0040 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 1.3960 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 3.4700 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 3.3560 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 3.1230 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 3.0090 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 5.3120 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 5.4260 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 5.0800 -2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7860 4.9660 -0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7990 6.8950 -2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 7.0090 -3.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3180 9.1730 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9190 9.2870 -2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4230 9.0060 -4.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8220 8.8920 -3.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4440 11.2930 -2.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2500 13.4640 -3.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7460 13.3240 -6.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9240 6.8760 -1.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2460 7.2140 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 39 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 38 1 0 0 0 0 40 41 1 0 0 0 0 M END