IBS-ZINC02147930 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 71 0 0 1 0 0 0 0 0999 V2000 0.0660 1.7430 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 0.2130 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -0.2900 1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -0.2730 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -0.2990 -1.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9850 0.0390 -1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5500 0.7430 -0.5140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 -0.4040 -2.4130 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0540 -0.0360 -2.6120 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4200 -0.4830 -3.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 1.4870 -2.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4560 1.9780 -3.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0040 2.2220 -5.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 2.6540 -6.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1970 2.8920 -6.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 2.7010 -5.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 2.2740 -4.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 2.2140 -3.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 2.5670 -3.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 2.9860 -4.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 3.0600 -5.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8750 -0.5380 -1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3370 -0.8100 -0.4050 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2030 -0.6850 -1.5830 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8960 -1.0440 -0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8680 -2.3640 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5660 -2.7350 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3020 -1.7850 1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0510 -2.1470 3.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2860 -3.4610 3.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9930 -3.7200 4.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4710 -2.6770 5.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2470 -1.3590 4.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5380 -1.0860 3.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2600 0.2860 3.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2090 1.2150 4.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0650 0.4770 2.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3380 -0.4520 1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6310 -0.0930 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1630 -2.9540 6.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3600 -4.3330 6.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 2.0890 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 2.1020 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 2.1280 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 0.0940 2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -1.3800 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 0.0560 1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 0.0860 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 -1.3620 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8990 0.1120 0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 -0.9660 -3.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 1.9390 -1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2270 1.7660 -2.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0480 2.0950 -5.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 1.8880 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 2.5200 -2.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 3.2620 -5.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 3.3850 -6.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2980 -3.1000 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5410 -3.7600 1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9180 -4.2760 2.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1770 -4.7420 4.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6190 -0.5530 5.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6500 0.9300 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 -4.8200 6.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9120 -4.8180 5.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9240 -4.4140 7.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 45 1 0 0 0 0 3 46 1 0 0 0 0 3 47 1 0 0 0 0 4 48 1 0 0 0 0 4 49 1 0 0 0 0 4 50 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 51 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 11 12 1 0 0 0 0 11 52 1 0 0 0 0 11 53 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 55 1 0 0 0 0 19 20 2 0 0 0 0 19 56 1 0 0 0 0 20 21 1 0 0 0 0 20 57 1 0 0 0 0 21 58 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 39 2 0 0 0 0 26 27 2 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 27 60 1 0 0 0 0 28 29 1 0 0 0 0 28 38 2 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 61 1 0 0 0 0 31 32 1 0 0 0 0 31 62 1 0 0 0 0 32 33 2 0 0 0 0 32 40 1 0 0 0 0 33 34 1 0 0 0 0 33 63 1 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 64 1 0 0 0 0 40 41 1 0 0 0 0 41 65 1 0 0 0 0 41 66 1 0 0 0 0 41 67 1 0 0 0 0 M END