PUBCHEM-ZINC03870445 MOE2007 3D CORINA 3.40 0006 02.08.2006 82 85 0 0 1 0 0 0 0 0999 V2000 1.9980 2.4200 1.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0040 1.8500 2.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3350 2.1440 2.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2540 1.6410 2.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5930 2.9780 1.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5150 3.1710 0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 3.5590 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 3.2900 0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 3.8760 -0.1710 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7490 3.1240 -0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 5.0990 -0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8320 4.7160 -1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 4.4990 -0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 4.2560 0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 4.7970 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6540 4.7810 0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7050 5.3220 1.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0780 5.3050 0.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1290 5.8460 1.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5030 5.8300 1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5540 6.3710 1.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9280 6.3550 1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9780 6.8960 2.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3520 6.8790 1.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4030 7.4210 2.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.7530 7.9500 2.8310 C 0 0 3 0 0 0 0 0 0 0 0 0 -16.5110 7.6880 3.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.7840 9.4700 2.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.0080 9.9950 3.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.2630 9.5570 2.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.2240 8.0780 2.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.0880 7.3540 2.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.1240 5.9770 2.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.3040 5.3840 1.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -20.4720 6.1640 1.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -21.5410 5.6530 1.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 -20.4060 7.4750 2.0910 N 0 0 0 0 0 0 0 0 0 0 0 0 -21.2180 8.0060 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 2.2010 1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 1.1840 3.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 5.4080 -1.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8300 5.9150 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6400 3.7970 -2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 5.5190 -2.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2800 5.4580 -0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8370 4.0770 -1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4850 3.2340 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 4.8810 -0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 4.1720 1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 5.8190 1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6280 5.4050 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9090 3.7580 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7300 4.6970 2.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4490 6.3440 1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0530 5.9300 -0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3340 4.2830 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1550 5.2220 2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8740 6.8690 1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4770 6.4550 0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7580 4.8080 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5800 5.7460 2.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2980 7.3930 2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9020 6.9800 0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1830 5.3320 1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0040 6.2710 3.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7230 7.9180 2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3260 7.5040 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6080 5.8570 1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.4290 6.7960 3.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1480 8.4430 2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.8760 9.8970 3.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.8620 9.7430 1.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.0200 9.5790 4.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.9710 11.0830 3.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -20.1410 9.7830 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.3260 10.1040 1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.2160 5.3930 2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.3410 4.3290 1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 4.2720 0.7720 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 3.6830 1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.7220 7.4050 1.9380 N 0 0 0 0 0 0 0 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