IBS-ZINC05141130 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 0 0 0 0 0 0999 V2000 3.6100 0.0580 0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1530 -1.3500 0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 -2.3950 1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2200 -3.6780 0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 -3.9420 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 -5.3050 -0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -5.4990 -1.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -4.4040 -2.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 -3.1490 -2.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -2.8840 -1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 -1.5850 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -4.6010 -3.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -6.8900 -1.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -7.0000 -1.5390 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7770 -7.3640 -2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 -7.3430 -2.2530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 -7.7960 -3.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4500 -8.3890 -4.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 -6.5860 -4.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -8.8510 -3.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 -6.7150 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -6.6170 0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 -5.3900 -0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 -7.8410 0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 0.2700 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 0.7590 0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8240 0.1630 1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3100 -2.1920 1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5890 -4.4860 1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -6.1370 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 -0.7640 -1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -2.4190 -2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -7.0890 -2.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 -7.6150 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2310 -7.6370 -4.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 -8.7020 -5.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8530 -9.2510 -4.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -6.1750 -4.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 -6.8950 -5.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 -5.8260 -4.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 -9.8070 -3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -8.9540 -4.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -8.5440 -2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 -5.6600 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4930 -6.6920 1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -7.4290 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0350 -5.4920 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 -5.1270 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 -4.6070 -0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 -8.7850 0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6270 -7.6290 1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1390 -7.9110 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 11 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 11 31 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 37 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 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 M END