IFLAB-ZINC04164639 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 0.1340 1.6510 -0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 0.1350 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -0.3290 1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -1.8320 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 -2.5880 0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 -3.9820 0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 -4.6420 1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 -3.8940 1.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 -2.4970 1.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 -6.0050 1.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 -6.7310 1.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -8.2230 1.9460 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0260 -8.3640 2.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 -9.0460 2.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9380 -11.2490 3.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 -12.7660 2.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -12.4820 3.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -10.9690 3.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 -14.7540 3.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -15.2880 4.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -8.7060 0.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -9.6710 0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 2.0420 -0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 1.9620 -1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 2.1100 0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 -0.2250 -0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 -0.2920 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 0.0400 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 0.1060 1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 -2.1000 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6060 -4.5560 0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -4.3590 2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 -1.9320 2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 -6.4170 3.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -6.5460 1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 -8.7650 3.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0030 -8.7980 2.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -10.9380 2.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0840 -11.0250 4.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 -13.2920 3.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7310 -13.0410 1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -12.7520 2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 -12.7950 3.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 -10.7280 4.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -10.4670 2.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -14.9780 2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3430 -15.1930 3.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 -14.9490 4.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -14.9800 5.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -16.3820 4.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -10.5030 2.6150 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 -13.2540 3.6290 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5990 -13.0420 4.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 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 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 51 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 51 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 17 52 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 52 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END