CHEMSTAR-ZINC04016580 MOE2007 3D CORINA 3.40 0006 02.08.2006 88 89 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -0.1240 2.4970 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2110 0.9530 2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -0.5140 3.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -1.2970 4.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 0.0080 3.9280 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 -0.3720 5.1180 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0570 -0.5200 5.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7330 0.7390 5.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 1.9850 5.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 2.2000 7.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9510 3.3410 7.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 4.2720 6.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 4.0540 5.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6360 2.9140 4.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 5.3960 6.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 6.3100 5.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 7.4870 6.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 8.5990 6.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 9.6780 7.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 9.6450 7.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2160 8.5340 7.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 7.4570 6.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -1.6510 4.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3890 -2.1930 3.7660 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2630 -2.1940 5.8060 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9910 -3.4370 5.5420 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3920 -4.0780 4.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3180 -3.1150 4.8540 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9170 -2.4740 5.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0780 -4.4140 4.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0640 -2.4420 3.6190 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2590 -4.1480 6.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8810 -3.6650 7.8850 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9180 -5.3170 6.8470 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1410 -5.9450 8.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 -0.8210 2.5030 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3820 -0.2980 1.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 0.7510 1.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5660 -0.9390 1.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6550 -0.3180 1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2670 -0.1840 -0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9100 -1.1840 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9350 1.0700 1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -1.5960 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -0.0630 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 0.6340 3.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3630 0.4200 6.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3560 0.9480 4.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 1.4750 7.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 3.5090 8.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 4.7780 4.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9070 2.7460 3.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 6.6590 5.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 5.8080 5.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6200 8.6240 6.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 10.5460 7.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0550 10.4880 7.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2930 8.5090 7.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 6.5900 6.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3400 -1.7600 6.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4800 -5.0550 3.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0240 -4.1850 4.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2730 -4.9280 5.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5840 -1.6080 3.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7260 -5.2780 8.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1820 -6.1480 8.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6820 -6.8810 7.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 -1.6580 2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0670 -1.1720 -0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0840 0.2830 -0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3720 0.4340 -0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1870 -1.2800 2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7280 -0.7180 0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7100 -2.1720 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0410 1.6870 1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7530 1.5360 1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2120 0.9740 2.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 48 1 0 0 0 0 1 49 1 0 0 0 0 1 50 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 51 1 0 0 0 0 3 52 1 0 0 0 0 3 53 1 0 0 0 0 3 54 1 0 0 0 0 4 5 1 0 0 0 0 4 55 1 0 0 0 0 4 56 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 40 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 57 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 27 1 0 0 0 0 12 13 1 0 0 0 0 12 58 1 0 0 0 0 12 59 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 60 1 0 0 0 0 15 16 1 0 0 0 0 15 61 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 62 1 0 0 0 0 18 63 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 64 1 0 0 0 0 20 65 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 66 1 0 0 0 0 23 24 1 0 0 0 0 23 67 1 0 0 0 0 24 25 2 0 0 0 0 24 68 1 0 0 0 0 25 26 1 0 0 0 0 25 69 1 0 0 0 0 26 70 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 71 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 36 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 34 72 1 0 0 0 0 34 73 1 0 0 0 0 34 74 1 0 0 0 0 35 75 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 38 39 1 0 0 0 0 39 76 1 0 0 0 0 39 77 1 0 0 0 0 39 78 1 0 0 0 0 40 41 1 0 0 0 0 40 79 1 0 0 0 0 41 42 2 0 0 0 0 41 43 1 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 44 47 1 0 0 0 0 45 80 1 0 0 0 0 45 81 1 0 0 0 0 45 82 1 0 0 0 0 46 83 1 0 0 0 0 46 84 1 0 0 0 0 46 85 1 0 0 0 0 47 86 1 0 0 0 0 47 87 1 0 0 0 0 47 88 1 0 0 0 0 M END