IFLAB-ZINC04062453 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.0030 1.4910 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -0.0120 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -0.8090 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -2.1990 0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3180 -3.4380 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -4.5830 0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -4.5050 -0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -3.2840 -1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -2.1170 -0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 -0.7830 -1.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -0.2770 -2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -0.3650 2.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 0.8220 2.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -1.3700 3.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 -1.8520 4.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 -1.7410 4.0990 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 -2.6450 5.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 -1.8700 6.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2650 -1.1360 5.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2090 -0.7460 6.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3430 -0.0620 6.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5450 0.2410 5.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6120 -0.1490 4.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4720 -0.8420 4.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 -1.2560 3.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 1.9310 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 1.8160 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 1.8120 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -3.5000 2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 -5.5460 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -5.4090 -1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -3.2350 -2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -0.0740 -2.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -1.0220 -3.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 0.6420 -2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 -3.5070 4.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -2.9780 5.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 -2.5670 7.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -1.1520 6.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 -0.9800 7.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0720 0.2370 7.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4300 0.7790 4.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7680 0.0880 3.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 -0.4010 2.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9520 -2.0520 2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 M END