PUBCHEM-ZINC04533005 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 70 0 0 1 0 0 0 0 0999 V2000 -0.2890 1.2410 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -0.2490 0.3430 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1580 -0.7080 0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 -0.9370 1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -0.8700 2.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -1.7020 3.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 -2.1130 3.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -0.4930 -1.1430 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2610 -0.1110 -1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -2.0120 -1.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -2.1550 -2.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -0.7230 -3.4860 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0240 -0.4500 -3.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 0.1190 -2.3140 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3190 1.6260 -2.6120 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5850 1.9390 -2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 1.9590 -4.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 1.0790 -5.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0170 1.1490 -4.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -0.4090 -4.8900 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2720 -0.5730 -5.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7360 -1.3040 -5.4390 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5090 -1.4690 -4.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 -0.7180 -6.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 0.2690 -7.3970 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4820 -0.2780 -7.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 1.5300 -6.5050 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0650 2.2330 -7.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 2.5860 -8.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 1.4270 -9.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 0.6460 -8.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 2.5300 -6.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 -2.5800 -5.7630 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -3.1610 -6.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 2.4570 -2.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 3.3350 -1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1280 -0.1500 -2.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 1.7690 0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 1.7160 0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.4040 1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -1.9950 1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 -0.4900 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 0.1620 3.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 -1.2100 2.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -2.4180 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -2.5880 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -2.7690 -3.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 -2.6450 -3.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 3.0180 -4.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 1.8030 -4.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 -1.5230 -7.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3210 -0.2060 -6.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 3.1550 -6.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 1.5810 -7.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 3.4320 -8.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 2.9400 -8.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 1.8020 -10.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 0.7320 -9.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 -0.2590 -9.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7170 1.2260 -8.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 3.3900 -5.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 2.9300 -7.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2910 2.0640 -6.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4930 0.3920 -1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7550 0.1550 -2.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3390 -1.2090 -1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -1.8650 4.8690 O 0 5 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 8 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 2 0 0 0 0 6 67 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 35 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 27 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 33 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 31 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 30 58 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 33 34 1 0 0 0 0 35 36 1 0 0 0 0 37 64 1 0 0 0 0 37 65 1 0 0 0 0 37 66 1 0 0 0 0 M CHG 1 67 -1 M END