IFLAB-ZINC04166946 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -1.8100 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 -2.3270 -2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -3.6940 -2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -4.5480 -1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -4.0360 -0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -2.6690 -0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -6.0400 -1.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 -6.5240 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1270 -5.7360 -0.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7030 -7.8330 -1.2460 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9440 -8.3040 -0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 -9.8180 -0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3390 -10.3030 -0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3640 -11.2700 0.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0420 -11.5220 1.2280 S 0 0 0 0 0 0 0 0 0 0 0 0 7.5430 -10.3030 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5220 -9.8110 -0.4780 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9700 -9.8690 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 -1.6600 -3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 -4.0970 -3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -4.7040 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -2.2690 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -6.5310 -1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 -6.2770 -2.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -8.4640 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7950 -7.8130 -1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9310 -8.0670 0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 -10.3100 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0760 -10.0560 -1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 -11.8020 1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6270 -10.4520 0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2480 -10.0300 -1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0680 -8.8110 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 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 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 M END