IFLAB-ZINC04554432 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 2.2320 1.4960 1.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 2.1730 4.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 3.4160 2.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 3.8970 3.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 5.2740 3.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 5.7350 4.4960 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 6.9310 4.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 7.6280 3.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 7.4010 5.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9100 6.7040 6.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3780 8.5980 5.4680 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2250 9.0580 6.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7250 10.4730 6.2730 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3590 10.4550 5.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5200 10.9820 7.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9200 11.1010 8.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6450 11.5680 9.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9770 11.9170 9.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5820 11.7960 8.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8470 11.3330 7.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8820 12.1980 8.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9540 12.9500 9.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8980 12.3940 10.4970 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 10.8990 6.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 11.8130 6.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 13.1640 6.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 13.6450 6.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9050 12.7490 6.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 0.5180 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0460 2.1420 1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 1.3850 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 2.7870 3.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 1.1710 4.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 2.6190 4.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 3.3490 1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 4.1230 2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 3.1900 3.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 3.9640 4.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 5.9810 3.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 5.2070 2.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 5.1780 5.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2590 9.1540 4.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0770 8.3860 6.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6470 9.0640 7.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8820 10.8290 8.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1730 11.6600 10.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3120 11.2430 6.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7750 14.0090 9.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9210 12.8040 10.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 9.8770 6.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6030 10.9320 7.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 11.5110 7.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 11.7390 5.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9210 14.6670 6.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 13.6240 5.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1360 12.8120 7.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7670 13.0770 5.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 2.0940 2.9040 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 11.3590 6.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 58 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 58 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 58 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 59 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 59 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 59 1 0 0 0 0 M END