IFLAB-ZINC03865082 MOE2007 3D CORINA 3.40 0006 02.08.2006 76 78 0 0 1 0 0 0 0 0999 V2000 2.2760 2.0790 -5.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 1.6910 -3.6540 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1440 2.1020 -3.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2430 2.2510 -2.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 1.8630 -1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0260 0.3380 -1.2320 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9670 -0.0730 -1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 -0.2210 -2.0610 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9280 0.1900 -1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 0.1670 -3.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 -1.6450 -1.9440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -2.6140 -3.1280 P 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -2.0340 -3.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6570 -2.7840 -4.3760 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8510 -1.8140 -4.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 -3.2880 -3.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 -4.6480 -3.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3480 -5.0660 -3.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2030 -4.1200 -2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9180 -2.8350 -2.5790 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8190 -2.4010 -3.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 -3.7110 -5.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -4.0620 -2.5210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -4.2800 -1.6020 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6690 -3.3630 -1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 -4.6790 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 -5.9650 -0.3850 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7030 -6.2500 0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 -7.0850 -0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -6.6850 -2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 -5.3990 -2.1260 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8080 -5.5650 -1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5590 -4.9990 -3.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4610 -6.1190 -4.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 -3.7130 -3.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 -5.7330 -1.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8360 -0.0500 0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0590 0.3910 1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 0.6390 0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2170 1.6680 -5.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 1.6810 -5.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 3.1660 -5.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1840 1.8400 -3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2620 3.3370 -2.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8770 2.2620 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1110 2.2740 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -0.2320 -4.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.2440 -3.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 -5.3640 -4.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5860 -6.1170 -2.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1150 -4.4380 -2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6210 -1.3400 -3.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -4.5970 -5.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -3.8820 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 -4.8450 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 -8.0010 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 -7.2500 -0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -6.5190 -2.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 -7.4820 -2.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 -4.8340 -4.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2790 -6.2840 -3.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8670 -5.8340 -4.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 -7.0350 -4.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1930 -3.8790 -2.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 -2.9160 -2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 -3.4280 -4.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 -4.8060 -1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1460 -6.5650 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -5.6600 -2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 -1.1310 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 0.0300 2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9600 -0.0220 0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1190 1.4800 1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 0.3250 0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 0.3620 1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 1.7200 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 45 1 0 0 0 0 5 46 1 0 0 0 0 6 7 1 0 0 0 0 6 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