IFLAB-ZINC05146850 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 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 0.6600 -1.9920 -1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -2.6070 -2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -1.8360 -3.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -0.4460 -3.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 0.1630 -2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 -2.4950 -4.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -1.8650 -5.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 -2.8470 -6.2660 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 -2.9350 -7.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5310 -4.1320 -7.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8800 -5.2870 -6.7680 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 -4.0360 -5.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 -3.8230 -4.5540 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6530 -1.6900 -8.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5060 -1.2200 -9.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 -1.8340 -9.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 -0.1150 -9.8240 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 0.3430 -10.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 1.1670 -11.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1090 1.2650 -12.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 1.9820 -12.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 1.0010 -11.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 1.0720 -10.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6140 1.2190 -9.8400 C 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 0.2220 -2.5890 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -3.6850 -2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 0.1540 -3.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 1.2410 -2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 -0.7970 -5.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0520 -4.3590 -8.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9190 -0.9100 -7.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5120 -1.9110 -8.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4770 0.3760 -9.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 -0.5180 -11.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3070 2.1710 -11.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9770 0.6970 -12.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 1.8160 -13.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 0.2600 -13.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 2.8220 -11.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 2.3400 -13.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 1.2110 -12.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -0.0070 -12.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 1.9260 -9.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 0.1630 -9.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7180 0.9540 -8.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 2.2590 -9.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 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 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 M END