IBS-ZINC04029421 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 64 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -1.9620 0.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 -2.5960 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6710 -3.9820 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8950 -4.6240 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0640 -3.8850 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0120 -2.5040 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7900 -1.8570 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3970 -4.5880 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8060 -4.8170 1.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0650 -5.4810 1.5100 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.2420 -6.1300 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1330 -6.2850 2.8230 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.6780 -7.2150 2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8210 -5.4840 3.7870 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2230 -4.2340 3.2140 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.5860 -3.4060 3.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2130 -4.4550 1.6660 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.0760 -3.5460 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4710 -5.1290 1.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3770 -4.5470 2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6130 -4.0080 3.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.3360 -5.6210 2.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1770 -3.4290 1.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7180 -6.5930 3.3170 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1580 -5.6740 3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7550 -7.4680 4.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4940 -8.1650 4.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0450 -8.1460 3.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0220 -7.4580 2.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8820 -9.5800 2.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7030 -7.4170 3.0990 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 -4.5590 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9380 -5.7030 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9260 -1.9290 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7500 -0.7780 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1380 -3.9670 -0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3090 -5.5420 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7660 -6.4150 3.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0220 -5.1770 3.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9030 -6.0350 2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7440 -3.8380 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8640 -2.9890 2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4940 -2.6620 1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8180 -6.8440 5.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5860 -8.1720 4.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8340 -10.1050 2.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5660 -9.5630 1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1310 -10.0950 3.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9610 -7.9490 3.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3770 -7.3820 2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8150 -6.4020 3.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 13 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 17 1 0 0 0 0 15 27 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 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 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 32 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 33 56 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 34 59 1 0 0 0 0 34 60 1 0 0 0 0 34 61 1 0 0 0 0 M END