IFLAB-ZINC04568855 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 2.4700 2.3030 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 2.2130 1.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 2.9160 2.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 3.6060 4.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 2.9030 3.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 3.5160 4.7600 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4520 3.2070 5.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 3.0520 4.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9850 1.5890 4.1850 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1100 0.9500 3.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1100 1.5880 3.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1280 -0.5220 3.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7860 -1.1610 2.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8060 -2.5420 2.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1640 -3.2910 3.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 -2.6670 4.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4830 -1.2880 4.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8100 -0.6810 5.9990 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.4370 -0.4310 1.4430 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 5.0180 4.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 5.6700 3.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 7.0470 3.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 7.7790 4.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 7.1230 5.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 5.7420 5.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 8.0540 6.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 9.3110 6.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 9.1210 4.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 2.3760 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 1.2540 1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4100 2.8330 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 1.1780 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 2.2370 0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 3.9430 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 2.3890 2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 3.5820 5.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 4.6420 3.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7640 3.4310 3.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 1.8760 3.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7330 3.3840 4.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1640 3.4760 3.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 1.0810 4.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -3.0360 1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1780 -4.3690 3.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7830 -3.2600 5.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 5.1010 2.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2960 7.5530 2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 5.2310 6.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 9.5110 6.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 10.1210 6.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 2.9030 1.8660 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 2.9160 3.9220 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 51 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 51 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 52 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 51 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 6 52 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 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 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 M END