CHEMDIV-ZINC06847220 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.4280 1.0650 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -0.3640 -0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8990 -0.6750 -1.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 0.2710 -2.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 2.6310 -1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 2.0830 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 2.1510 -3.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 3.3440 -4.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4390 3.7310 -5.5700 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 4.3200 -5.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3100 4.4980 -4.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 4.6110 -6.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4670 5.5380 -7.6810 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7620 6.9770 -7.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 7.5700 -9.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4850 8.4830 -9.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7340 7.0490 -9.8160 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 7.3480 -11.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 6.7740 -11.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 5.6130 -10.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 6.1490 -9.2840 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0320 6.7400 -8.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 5.0740 -8.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 3.9510 -8.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 1.3230 -1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 1.1030 0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -0.5890 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 -1.0550 -0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 -1.6900 -1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -0.7070 -2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 0.4450 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 -0.1620 -2.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 3.4110 -1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 3.0660 -1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 2.9400 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 1.6630 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 1.3310 -4.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3690 2.3970 -3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 3.0990 -4.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 4.2180 -3.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 3.5840 -6.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2990 5.0140 -6.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3570 3.6610 -7.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 7.4670 -7.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7520 7.1370 -7.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6050 8.4230 -11.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 6.8350 -11.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 7.5240 -11.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 6.4620 -12.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 5.3350 -10.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 4.7310 -10.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 1.6080 -2.5090 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6010 1.4270 -2.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 52 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 52 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 7 52 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END