IFLAB-ZINC04486141 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.0310 1.4040 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -0.0370 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -0.6720 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 -1.9940 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -2.6860 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -2.0570 -1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 -0.7300 -1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 -0.0920 -2.3750 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 -0.7740 -3.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 0.0530 -4.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 0.3110 -5.1180 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 0.8670 -4.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 0.0070 -3.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 0.0400 -6.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 -0.4540 -7.1760 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -0.6670 -8.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7070 -1.1240 -9.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -0.3100 -8.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -0.4160 -10.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -0.7740 -11.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -0.2310 -11.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 -0.5680 -12.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7180 -1.4470 -13.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 -1.9930 -13.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -1.6560 -12.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -2.8540 -14.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -3.3740 -14.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 -1.7770 -14.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 0.2970 -7.5630 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 2.0510 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 1.5820 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 1.6220 0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -0.1350 2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -2.4880 2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -3.7180 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -2.5970 -2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 -1.7600 -3.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 -0.8810 -2.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -0.5010 -4.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 1.0000 -3.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 0.8500 -5.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 1.8920 -4.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 0.4680 -2.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 -0.9890 -3.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 -0.2360 -10.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5700 0.4530 -10.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1160 -0.1490 -12.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -2.0740 -12.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 -4.0460 -15.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 -2.5530 -14.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 -3.9220 -13.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5300 -1.1930 -15.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 M END