IBS-ZINC00054962 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 0 0 0 0 0 0999 V2000 -0.0520 1.6770 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 0.3870 0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -0.4020 -0.9460 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 -1.6020 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 -1.9960 0.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 -2.3240 -1.8970 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 -3.6460 -1.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4480 -3.7400 -2.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 -1.9270 -4.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -1.8550 -3.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1170 -3.4720 -5.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3110 -4.9440 -5.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0090 -5.4990 -5.8700 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0630 -6.4530 -6.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9650 -7.7880 -6.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9840 -8.7940 -7.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0860 -8.4600 -8.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1600 -7.1190 -9.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1400 -6.1000 -8.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1910 -4.7570 -8.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 -4.3740 -9.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 2.2270 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 1.4680 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 2.3150 0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 0.6110 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -0.1630 0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5920 -3.8910 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 -4.3740 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2590 -3.0660 -2.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8170 -4.7670 -2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -1.7150 -5.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2160 -1.2350 -3.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -2.5030 -3.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 -0.8320 -3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0270 -3.0060 -4.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7760 -2.9260 -6.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9900 -5.0180 -6.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7630 -5.4970 -4.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8770 -8.0430 -5.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9160 -9.8370 -7.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1000 -9.2470 -9.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2310 -6.9100 -10.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0970 -4.7300 -10.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 -4.7200 -10.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2000 -3.2800 -9.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0150 -3.3270 -4.2170 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2800 -3.9860 -4.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 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 10 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 9 46 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END