IBS-ZINC02205130 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0110 1.4940 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -0.0360 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -0.5120 -1.1930 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -0.7780 -1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 -1.1780 -2.5600 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -1.1830 -3.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -0.7880 -2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -0.6380 -2.8310 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -1.1710 -4.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 -1.1220 -5.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8470 -0.7630 -4.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1120 -1.4780 -6.4310 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4120 -1.5450 -6.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4860 -1.7590 -6.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7680 -1.8240 -6.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9830 -1.6760 -7.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9160 -1.4630 -8.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6310 -1.3900 -8.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -1.1510 -9.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0740 -0.6350 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2000 -1.9310 0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0220 -2.9320 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9650 -4.0260 1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0970 -3.9130 2.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -2.3520 1.9360 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 1.8640 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 1.8600 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 1.8480 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -0.4020 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -0.4050 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -0.5070 -5.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 -2.1900 -4.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -1.6890 -7.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3200 -1.8750 -5.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6040 -1.9910 -5.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9870 -1.7270 -8.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0860 -1.3480 -9.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 -2.1070 -9.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8000 -0.5540 -10.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6810 -0.6190 -8.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0290 -0.3920 -0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7910 0.1620 0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6830 -2.8920 -0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5780 -4.9040 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9180 -4.6640 2.7800 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 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 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 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 M END