IFLAB-ZINC04033718 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 0 0 0 0 0 0999 V2000 0.0900 1.5190 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0040 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -0.4620 1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -0.4290 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -0.6170 -1.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 -0.4260 -1.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8630 0.6350 -0.2750 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 -1.0710 -2.3000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0940 -0.8640 -2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5800 -1.7060 -3.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0590 -1.4940 -3.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9450 -2.3540 -3.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3730 -2.1210 -3.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3370 -2.9780 -2.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6780 -2.7270 -3.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0750 -1.6380 -3.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1390 -0.7840 -4.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7800 -1.0160 -4.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8270 -0.1780 -4.8280 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1080 0.5840 -5.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5160 -0.4040 -4.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7020 0.3540 -5.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5440 0.2800 -5.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9520 0.4560 -5.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9540 -4.0460 -2.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9910 -4.8720 -1.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 1.8330 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 1.8340 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 1.9760 0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -0.1210 2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -1.5500 1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 -0.0420 1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9430 -0.1030 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -1.5150 0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 0.0270 0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -1.1600 -1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 -1.6720 -2.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2860 0.1900 -2.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 -1.1630 -1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3880 -2.7600 -3.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0470 -1.4070 -4.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6030 -3.1930 -2.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4230 -3.3840 -2.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1270 -1.4530 -4.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1370 1.3390 -6.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4210 0.5860 -4.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3710 -0.4210 -5.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5830 -5.2840 -2.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6330 -4.2770 -1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5490 -5.6860 -1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 M END