PUBCHEM-ZINC04097713 MOE2007 3D CORINA 3.40 0006 02.08.2006 81 85 0 0 1 0 0 0 0 0999 V2000 2.4310 1.7630 1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 0.2410 1.2070 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6010 -0.1870 1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6450 -0.1300 2.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 -1.6510 2.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0440 -2.2820 0.9650 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4540 -1.8990 0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8450 -2.6540 -0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8810 -2.3640 -1.8900 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4510 -2.4130 -1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 -2.9430 -2.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6850 -3.5660 -3.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0280 -3.1280 -4.0970 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9420 -2.0420 -4.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1240 -3.3300 -3.0630 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5190 -3.1100 -3.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7100 -3.9110 -4.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6690 -3.4110 -5.9320 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7100 -2.2920 -5.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2770 -3.7960 -5.4500 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2420 -3.2410 -6.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5110 -3.8150 -7.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8820 -3.3760 -8.3300 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8880 -2.2870 -8.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -3.7670 -7.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3540 -5.2430 -7.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2460 -2.9490 -7.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1390 -3.9750 -9.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0850 -5.3060 -5.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0540 -4.7570 -2.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0390 -1.8400 -0.0960 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0490 -2.2470 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 -0.3210 -0.1670 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8930 0.1170 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8670 0.0890 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1680 -0.9430 -2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9530 -3.8060 1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3850 2.1840 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 2.0250 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 2.1640 2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6020 0.2620 1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4040 0.2960 3.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 -1.9270 3.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 -2.0350 2.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5130 -0.8260 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1580 -2.1630 1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8470 -2.2960 -1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9500 -3.7060 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -2.9330 -1.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6040 -4.6440 -3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 -3.2170 -4.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7110 -2.0680 -3.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2680 -3.4470 -2.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7180 -3.7150 -5.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6070 -4.9700 -4.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 -3.5280 -6.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3230 -2.1550 -6.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4300 -4.8970 -7.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 -3.4240 -8.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4710 -5.8540 -7.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6990 -5.4120 -8.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1420 -5.5150 -6.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0830 -3.1980 -7.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5050 -3.1890 -8.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0270 -1.8840 -7.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4970 -3.7370 -10.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 -5.5270 -4.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0870 -5.7260 -6.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8980 -5.7460 -4.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0430 -4.9590 -2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3170 -5.4720 -3.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7540 -4.8520 -1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 1.1770 -1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 -0.3040 -2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 -0.3140 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1630 -0.9060 -2.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 -0.6630 -3.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1180 -0.2480 -1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9440 -4.0770 1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1810 -4.2880 0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6670 -4.1340 1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 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 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 5 44 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 45 1 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 47 1 0 0 0 0 8 48 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 49 1 0 0 0 0 12 13 1 0 0 0 0 12 50 1 0 0 0 0 12 51 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 52 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 54 1 0 0 0 0 17 55 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 56 1 0 0 0 0 21 57 1 0 0 0 0 22 23 1 0 0 0 0 22 58 1 0 0 0 0 22 59 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 60 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 27 63 1 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