IBS-ZINC04074000 MOE2007 3D CORINA 3.40 0006 02.08.2006 82 86 0 0 1 0 0 0 0 0999 V2000 1.4280 2.5940 -0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 1.3770 0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 0.6800 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 0.9660 0.0200 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5590 -0.1260 -0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 1.6700 -1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5720 1.7250 -1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 1.9970 0.3810 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6220 1.2450 1.0640 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0740 0.2220 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 1.7470 2.4280 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1770 1.3980 3.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 1.0720 3.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 1.2260 4.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 2.2400 4.9930 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3080 1.7850 4.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 2.4360 6.5140 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0260 1.0410 7.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 1.2050 8.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 2.0090 9.0140 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3580 2.2120 10.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 3.3420 8.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 3.2180 6.8110 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9160 2.6310 6.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 4.5540 6.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 4.2720 4.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 3.5250 4.1870 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2690 3.2470 2.6700 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5400 3.8570 2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 3.5040 0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 3.9000 1.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 4.4720 4.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9240 3.7910 8.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 4.4010 9.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 1.2330 8.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 3.0480 7.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1480 1.4830 0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1850 2.1690 0.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 2.7900 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 2.4180 -1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 3.4540 -0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -0.2340 1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 1.0190 1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 2.6720 -1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 1.0820 -2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9840 2.5370 -1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0180 0.7730 -1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 0.0120 2.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 1.5330 2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 0.2490 5.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 1.5310 5.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 0.4420 6.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 0.5690 6.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 1.6530 9.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 0.1990 9.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 5.1670 6.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 5.1050 6.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 5.2410 4.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 3.6710 4.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 3.4680 2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4990 4.9490 2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 3.8710 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5260 3.9960 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 3.8920 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 4.9290 2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 3.3440 2.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 4.8460 5.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3820 5.3090 3.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3320 3.9290 4.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5590 3.0400 7.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 4.7440 7.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 3.9030 9.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 4.5950 9.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 5.3210 8.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 4.0420 9.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 0.4000 9.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3280 2.5690 6.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 2.8990 8.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 4.1160 6.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2220 0.4140 0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2530 1.6650 1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0780 1.8940 0.4020 H 0 0 0 0 0 0 0 0 0 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