ANALYTICONDISCOVERY-ZINC04147447 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 72 0 0 1 0 0 0 0 0999 V2000 0.9870 0.6400 -1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -0.8170 -0.9880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 -1.3640 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 -1.1640 -0.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -0.7060 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6720 -1.0480 0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2400 -1.8420 -0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4620 -2.3300 -1.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -1.9850 -1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -2.4680 -3.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 -3.2560 -3.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2420 -3.5920 -3.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 -3.1520 -2.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7260 -3.5900 -2.7850 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.4360 -2.3940 -2.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9820 -4.3880 -3.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9240 -4.5810 -1.4730 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4040 -4.0450 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5620 -4.8830 0.3280 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.7550 -4.5890 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2120 -6.3720 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8840 -6.7800 -1.1210 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7120 -7.8550 -1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6280 -6.0200 -1.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0220 -6.3890 -2.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1920 -7.1190 -3.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1820 -6.7780 -4.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9620 -5.6790 -3.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7560 -4.9420 -2.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4010 -3.9250 -2.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8500 -5.3540 -1.7520 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8330 -4.6600 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9480 -5.2930 -4.7710 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2350 -5.2060 -4.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5530 -5.5480 -3.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.2610 -4.6930 -5.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5930 -4.6020 -4.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5050 -4.1430 -5.7500 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.1560 -3.7720 -6.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8320 -3.8620 -7.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9150 -4.3130 -6.5420 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 0.8810 -1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 1.0190 -1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 1.1030 -0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -0.9680 1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 -2.4500 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6010 -1.0770 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -0.0750 0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2770 -0.6770 0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 -2.0970 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -2.2150 -3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 -3.6270 -4.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6760 -4.2190 -4.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5910 -4.0610 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7380 -3.0170 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3470 -6.5500 0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0620 -6.9510 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3820 -6.2820 -2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7950 -6.2700 -0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5550 -7.9720 -3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3280 -7.3710 -4.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6820 -5.0220 0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9570 -3.5910 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7060 -5.0890 -5.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8790 -4.9060 -3.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9030 -3.3970 -7.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5520 -3.5570 -8.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 45 1 0 0 0 0 3 46 1 0 0 0 0 3 47 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 48 1 0 0 0 0 6 7 2 0 0 0 0 6 49 1 0 0 0 0 7 8 1 0 0 0 0 7 50 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 51 1 0 0 0 0 11 12 2 0 0 0 0 11 52 1 0 0 0 0 12 13 1 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 18 54 1 0 0 0 0 18 55 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 32 1 0 0 0 0 21 22 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 25 26 2 0 0 0 0 25 31 1 0 0 0 0 26 27 1 0 0 0 0 26 60 1 0 0 0 0 27 28 2 0 0 0 0 27 61 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 33 34 1 0 0 0 0 33 64 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 37 1 0 0 0 0 36 41 2 0 0 0 0 37 38 2 0 0 0 0 37 65 1 0 0 0 0 38 39 1 0 0 0 0 39 40 2 0 0 0 0 39 66 1 0 0 0 0 40 41 1 0 0 0 0 40 67 1 0 0 0 0 M END