ENAMINE-ZINC06831343 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 0 0 0 0 0 0999 V2000 -1.3230 0.4440 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 0.9970 1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 2.5790 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 3.1630 1.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1830 4.5310 1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6030 5.1090 2.6000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7200 6.3310 3.3400 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.2950 6.5420 4.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 6.0460 3.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1340 7.7330 2.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3380 8.3970 2.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6720 9.5060 1.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8180 9.9870 0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 9.2900 0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 8.1790 1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6710 9.6810 -0.4900 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6700 10.8630 -0.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 8.7920 -0.9600 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.1740 11.0620 -0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4740 11.7030 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5340 12.6870 -1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6410 12.2400 -2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6670 13.1560 -3.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5810 14.5240 -3.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4700 14.9790 -2.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4460 14.0610 -0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3290 14.5160 0.3020 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 -0.6000 -0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 0.9480 -1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2540 0.4930 -1.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 1.5690 0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 -0.0660 1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 1.3630 2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7650 2.5600 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 3.1460 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3120 2.4900 2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 3.2630 2.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 5.1880 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 4.4360 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3890 4.7110 3.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0280 8.0690 3.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6210 9.9980 1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 7.6630 1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4490 11.4580 -0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2710 10.9620 -0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6650 12.2060 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6940 11.1750 -2.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7480 12.8010 -4.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5970 15.2340 -4.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3960 16.0400 -1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 1.1440 0.5000 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3150 0.6390 0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 51 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 51 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M CHG 1 51 1 M END