IFLAB-ZINC04568624 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.2600 1.2170 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -0.1540 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7190 -0.6850 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 0.1650 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 1.5380 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 2.0610 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 3.5540 0.0360 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0510 4.0420 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 4.0340 -1.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0410 3.7720 -2.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 4.1860 -3.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 4.7740 -3.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2470 3.9190 -4.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2050 3.3310 -3.9160 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2590 4.3320 -5.6570 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 4.0710 -6.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1870 4.6390 -7.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4090 4.3670 -8.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1820 4.8970 -10.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 5.3380 0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 5.6380 1.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 5.1460 3.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 3.7410 3.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 3.4210 2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9570 -0.5930 0.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5520 -1.9060 -0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 -1.9760 0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 1.6290 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -0.8110 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4870 2.1990 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 3.5000 -1.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 5.1040 -1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 3.3020 -1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 4.8030 -6.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3060 4.5470 -6.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5950 2.9960 -6.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 4.1630 -8.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0210 5.7140 -7.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2860 4.8430 -8.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5750 3.2920 -8.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9180 4.7600 -10.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 5.6600 -0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 5.8720 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 6.7150 1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 5.1480 1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 3.4450 4.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 3.1950 2.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 3.9240 2.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 2.3450 2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 -2.0060 -1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1280 -2.6730 0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 3.8920 0.9000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 52 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 M END