IFLAB-ZINC04271889 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 1 0 0 0 0 0999 V2000 -0.5200 1.3210 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 0.0960 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -0.4270 1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 -1.5510 1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9550 -2.1560 -0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 -1.6390 -1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -0.5130 -1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 0.0100 -2.4110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -0.7130 -3.6810 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0890 -0.6710 -4.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 -0.1570 -4.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 0.9880 -5.0910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 -1.0350 -5.1040 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8150 -2.2870 -4.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 -3.1640 -4.9570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -2.4440 -3.4850 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.8150 -0.6260 -6.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2940 -0.8790 -7.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5280 -2.0980 -8.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -2.3370 -9.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -1.3450 -10.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 -0.1170 -9.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 0.1100 -8.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -1.5930 -11.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -2.6630 -11.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 2.2140 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 1.2880 -0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 1.3470 1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 0.0440 2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1950 -1.9570 1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 -3.0340 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5420 -2.1120 -2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 0.8510 -2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7280 -1.2000 -5.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0280 0.4370 -5.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0820 -2.8650 -7.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2370 -3.2890 -9.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 0.6540 -9.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 1.0610 -7.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -0.6340 -12.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -0.8430 -12.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 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 17 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 40 41 1 0 0 0 0 M END