IFLAB-ZINC05259503 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0870 1.4900 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 0.0100 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -0.7670 -1.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -2.1100 -0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -2.9230 -2.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 -4.2860 -1.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -4.8510 -0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3630 -4.0290 0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -2.6670 0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -6.3110 -0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -7.0240 -1.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -6.8540 0.8370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 -8.2440 0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 -8.8160 2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -10.1880 2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -11.0000 1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -10.4360 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -9.0520 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 -11.3070 -0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 -12.6880 -0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 -13.4580 -1.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 -12.8100 -2.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 -11.4960 -2.9350 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 -10.7780 -2.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1730 -13.5250 -3.8370 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 -12.7960 -4.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 1.6320 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 2.0820 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 1.8080 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -0.1320 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -0.3090 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -2.4860 -2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 -4.9180 -2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -4.4620 1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -2.0310 1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -6.2800 1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 -8.1850 2.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 -10.6280 3.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -12.0730 1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -8.6100 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 -13.1400 0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 -14.5290 -1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7560 -12.2770 -5.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0300 -13.4860 -5.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3630 -12.0680 -4.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 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 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 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 34 1 0 0 0 0 9 35 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 36 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 40 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 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 M END