IFLAB-ZINC04371030 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -2.5260 2.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 -3.8780 2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -4.8250 1.8330 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -6.0240 2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1730 -5.8200 3.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 -4.4450 3.6860 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9070 -3.7410 4.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -3.5160 5.9190 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0230 -2.9940 5.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 -2.6730 7.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 -2.3650 8.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 -1.6170 9.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2870 -1.1880 9.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7010 -0.4280 10.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8050 -0.0940 11.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -0.5200 11.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 -1.2760 10.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -0.1560 12.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 1.1710 11.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -4.7770 6.4570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 -6.9330 4.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2360 -6.7780 5.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 -8.1740 3.7810 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -8.9440 4.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 -8.3610 2.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 -9.4940 2.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -7.3230 1.9020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 -7.5670 0.6560 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 -1.8940 3.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7380 -4.3400 5.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 -2.7790 4.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 -3.2330 7.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9240 -1.7480 6.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9880 -1.4490 8.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7270 -0.0930 10.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1310 0.5000 12.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -1.6050 10.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -0.9380 12.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 -0.0550 13.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 1.0700 10.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 1.4350 12.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 1.9530 11.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 -5.2970 6.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -7.6130 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -8.5130 0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 -6.7580 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 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 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 23 53 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 24 56 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 M END