IFLAB-ZINC05258403 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 1 0 0 0 0 0999 V2000 -0.0540 1.4920 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -0.0150 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -0.7150 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -2.0980 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -2.7840 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -2.0850 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.6960 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -2.7760 -2.4240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -4.2410 -2.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -4.7420 -3.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -6.7300 -5.2610 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6260 -6.0620 -5.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 -8.1240 -5.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 -8.0260 -4.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 -6.9470 -4.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8860 -9.1380 -4.8290 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2590 -9.0350 -4.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9370 -7.8630 -4.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2920 -7.7650 -4.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9730 -8.8330 -4.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 -10.0010 -3.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 -10.1030 -4.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2110 -11.3750 -3.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0160 -6.5170 -4.9620 N 0 3 0 0 0 0 0 0 0 0 0 0 6.4170 -5.5760 -5.4530 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2100 -6.4290 -4.7420 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3690 -6.8100 -5.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2870 -6.4700 -5.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 1.8690 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 1.8550 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 1.8410 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1810 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -2.6410 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -3.8640 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -0.1480 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -2.2860 -3.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 -4.5950 -1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -4.6190 -1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -4.3880 -4.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -4.3640 -4.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -8.7680 -4.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -8.5460 -6.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 -10.0090 -4.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4060 -7.0300 -5.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0320 -8.7540 -3.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8350 -10.8330 -3.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2340 -12.0490 -4.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6920 -11.8540 -2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 -11.1410 -3.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -6.2110 -3.8860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -6.5650 -3.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 -7.2590 -7.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5330 -7.2930 -7.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 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 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 10 50 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 27 1 0 0 0 0 11 50 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 50 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END