IFLAB-ZINC05258840 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 43 0 0 1 0 0 0 0 0999 V2000 -0.0020 1.0930 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 1.0870 2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 3.0230 1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 3.4590 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8730 4.9830 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 6.8630 -1.0520 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8980 7.2480 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2380 7.2280 -1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3800 6.7260 -0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1550 6.1350 0.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6530 6.9350 -1.2670 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7110 6.3850 -0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6280 6.2770 0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7010 5.7270 1.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8090 5.3060 0.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8560 5.4220 -0.4900 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.8600 5.9450 -1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7730 7.4690 -1.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 6.7570 -2.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 0.0030 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 1.4730 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.4580 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 1.5230 2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 0.0000 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 1.3870 3.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 3.4720 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 3.3500 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3260 3.1320 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7260 3.0100 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 5.3100 1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 5.4320 -0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3090 8.3110 -1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2880 6.7670 -2.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8350 7.4650 -2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7500 6.6140 1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6720 5.6270 2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6490 4.8760 1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9360 6.0290 -2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 1.5600 1.1980 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 5.4020 -1.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4310 5.0550 -1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 8.8000 -1.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 9.1420 -2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 39 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 18 1 0 0 0 0 6 40 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 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 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 40 41 1 0 0 0 0 42 43 1 0 0 0 0 M END