IFLAB-ZINC02706734 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3800 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 0.1450 -0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -0.5310 -0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0320 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3070 1.2720 0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 1.9430 0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 -0.6500 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 0.0380 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7610 1.2540 -0.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0550 -0.6840 -0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0760 -2.0820 -0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2750 -2.7500 -0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4610 -2.0430 -0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4550 -0.6630 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2570 0.0270 -0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2480 1.3830 -0.3900 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5120 2.0400 -0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3060 3.5320 -0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1880 3.9890 -0.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3650 4.3600 -0.6010 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1390 6.0000 -0.5790 S 0 0 0 0 0 0 0 0 0 0 0 0 10.4310 6.5840 -0.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0940 6.2740 -1.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5170 6.4200 1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3930 6.7330 2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9060 7.0630 3.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5420 7.0790 3.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6660 6.7650 2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1540 6.4410 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9290 7.4920 5.0880 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9080 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 -0.2920 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3470 -1.4960 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 1.7120 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 2.9070 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6370 -1.6180 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1530 -2.6370 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2900 -3.8300 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3960 -2.5760 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3840 -0.1190 -0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1560 1.7500 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9800 1.7500 -1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2590 3.9940 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4580 6.7200 1.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5900 7.3070 4.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6000 6.7770 2.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4700 6.2000 0.4410 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 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 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 M END