IFLAB-ZINC04136062 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6070 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 0.1630 -2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -0.4430 -3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 -1.8370 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.6130 -2.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -1.9980 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -2.7500 -0.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 -4.1690 -0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 -2.4880 -4.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 -1.7660 -5.3070 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 -2.3840 -6.4000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1850 -1.6340 -7.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1360 -0.4200 -7.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8390 -2.2840 -8.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4400 -1.6560 -9.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9140 -2.6960 -10.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5990 -3.8350 -9.8400 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9790 -3.6270 -8.7350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6550 -4.3210 -8.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6380 -2.5380 -11.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9970 -1.2680 -12.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6700 -1.1220 -13.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9910 -2.2360 -14.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6340 -3.5090 -13.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9650 -3.6590 -12.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0600 -4.4250 -14.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0370 -3.7380 -15.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6400 -2.3570 -15.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 1.2410 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 0.1590 -3.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -3.6910 -2.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 -4.4590 -0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -4.6470 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 -4.4830 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 -3.5660 -4.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6800 -3.3520 -6.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5260 -0.5930 -9.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7480 -0.3980 -11.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9470 -0.1370 -13.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6920 -4.6450 -12.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0370 -3.8750 -14.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9970 -4.0870 -16.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 M END