IBS-ZINC04273371 MOE2007 3D CORINA 3.40 0006 02.08.2006 81 85 0 0 1 0 0 0 0 0999 V2000 1.5050 -0.1180 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -1.6100 0.9580 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6800 -2.1050 1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 -2.2280 1.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 -3.7280 1.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0370 -4.0780 0.1360 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5310 -4.0170 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8290 -4.5900 -1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1260 -3.7850 -2.6310 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7120 -3.4550 -2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 -3.3920 -3.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 -3.6920 -4.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4100 -3.7350 -5.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7720 -2.6860 -4.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1780 -4.5420 -3.9740 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6260 -4.7880 -4.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7260 -5.3190 -5.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1000 -4.2770 -6.7340 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5250 -3.2930 -6.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6050 -4.1930 -6.4570 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9900 -3.1170 -7.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 -3.4700 -8.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7510 -3.4850 -9.1070 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9180 -3.7980 -10.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 -4.4440 -8.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0020 -4.0840 -8.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3430 -5.8800 -8.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2820 -2.1640 -8.9460 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 -5.5090 -6.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4960 -5.9000 -3.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -3.2470 -0.8480 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2020 -3.7000 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 -1.7910 -0.5100 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1740 -1.4220 -1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2140 -0.8860 -0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9160 -2.4850 -2.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 -5.5280 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 -5.8050 -0.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 0.3740 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 0.3240 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 0.0120 2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 -1.7840 1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4660 -2.0420 2.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5390 -4.1760 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 -4.1720 1.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8870 -2.9930 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0640 -4.6170 0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9200 -4.4970 -1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6050 -5.6450 -1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -3.0970 -2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 -4.6260 -4.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 -2.8950 -5.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2320 -3.8870 -4.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0620 -5.5380 -3.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7840 -5.4530 -6.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2280 -6.2780 -5.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 -3.0790 -7.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4330 -2.1520 -7.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 -4.4240 -9.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 -2.7020 -9.4630 H 0 0 0 0 0 0 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-7.3980 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 48 1 0 0 0 0 8 49 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 51 1 0 0 0 0 12 52 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 53 1 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 17 55 1 0 0 0 0 17 56 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 25 1 0 0 0 0 20 21 1 0 0 0 0 20 29 1 0 0 0 0 21 22 1 0 0 0 0 21 57 1 0 0 0 0 21 58 1 0 0 0 0 22 23 1 0 0 0 0 22 59 1 0 0 0 0 22 60 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 28 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 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