IFLAB-ZINC04250866 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 0.4920 0.3240 -2.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -0.5300 -0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 -1.0680 -0.9930 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 -1.8480 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -2.0720 0.9530 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8720 -2.4290 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2840 -3.2380 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5500 -3.7790 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4190 -3.5220 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0120 -2.7170 -1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7500 -2.1670 -1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7010 -4.0720 0.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8890 -3.3710 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8910 -4.2440 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3580 -5.5150 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0100 -5.4060 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4770 -6.6110 -0.1930 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4390 -7.5300 -0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6590 -6.8650 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8500 -7.6100 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9280 -7.0490 -0.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7880 -8.9520 -0.2550 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6070 -9.5850 -0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5910 -10.7970 -0.4620 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4420 -8.9100 -0.3640 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1750 -9.6370 -0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0280 -9.7320 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3570 -3.9080 0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0240 -1.8760 0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 0.7280 -2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -0.2920 -3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 1.1440 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 -1.3500 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 0.0860 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6100 -3.4400 1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8690 -4.4050 1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6890 -2.5200 -1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4370 -1.5380 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8180 -9.9110 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3280 -10.5390 -1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4360 -9.0020 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3760 -9.8360 -1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8430 -10.7190 0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7880 -9.2200 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4770 -2.8290 0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8630 -4.2500 -0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7920 -4.4030 1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1900 -1.4360 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8690 -1.6450 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1120 -1.4660 0.7220 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 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 M END