IBS-ZINC04746218 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 0.7770 0.0440 1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 0.7500 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 1.9440 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.4220 -0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 1.7300 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0740 0.5280 0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 2.2160 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3130 0.8700 -1.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7600 1.0060 -3.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1000 1.7240 -3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0640 3.0870 -2.8530 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3440 3.7420 -3.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6240 2.9250 -1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4440 3.7320 -2.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1840 3.6450 -1.8920 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8290 4.3830 -4.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1620 4.9560 -4.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2940 5.3040 -5.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8630 5.6370 -6.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0470 4.6200 -5.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 3.6590 -1.0240 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5260 4.5800 -0.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 3.6970 -1.8630 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6230 -0.8870 1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 0.3690 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 2.4830 -0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 -0.0500 1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7930 3.2410 0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4200 1.6030 0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3060 0.4450 -1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 0.2450 -1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8350 0.0120 -3.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 1.5580 -3.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8900 1.1000 -3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3550 1.8350 -4.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3200 2.3180 -0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5090 3.9040 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1990 5.8530 -3.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9250 4.2520 -3.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9920 6.1270 -5.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6420 4.4290 -6.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6140 6.6530 -5.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6910 5.5710 -7.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9670 3.6750 -5.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0460 4.9870 -4.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 2.2320 -1.3370 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6050 2.8280 -1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 13 46 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 20 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M CHG 1 46 1 M END