IFLAB-ZINC02723403 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3760 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 1.2100 -0.6850 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 0.0240 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 1.4070 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 2.0900 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 3.5730 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 4.2760 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 5.9910 0.0930 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 5.5860 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 4.2960 -0.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1700 6.5040 -0.1720 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 7.8250 -0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 8.2130 -0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0320 8.8210 -0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 10.5040 -0.1700 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8400 11.5420 -0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4420 12.9950 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2740 13.3000 -0.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3830 13.9550 -0.3510 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0190 15.3800 -0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8990 16.0740 0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2710 15.7770 0.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6000 14.3890 0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8070 13.6100 -0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4430 -0.8680 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8640 -2.1200 -0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 -2.0210 -0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9030 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 1.9570 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 3.8620 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0840 6.1940 -0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7270 8.6720 0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5540 8.6800 -1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5160 11.3250 0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3430 11.3330 -1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1860 15.8310 -1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9690 15.4820 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7420 17.1510 0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6360 15.7120 1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6670 14.2550 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3430 14.0210 1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9420 12.5400 -0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1580 13.8800 -1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 -2.2290 -1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 -2.9540 0.0480 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 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 25 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 M END