PUBCHEM-ZINC06871406 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.1160 1.4550 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 0.8180 2.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 3.2200 1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 3.6000 2.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 5.0890 2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 5.4840 3.6450 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 5.6130 5.0730 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4350 6.4050 5.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 6.1030 5.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7910 6.3950 6.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1730 7.5910 7.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0480 7.6260 8.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 8.7510 9.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 9.8190 8.8390 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 9.7620 7.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7470 8.6820 6.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4840 5.6400 7.6390 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4290 6.1970 4.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7240 6.6050 4.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 5.7930 3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3390 5.7700 2.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 4.3200 5.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 4.1720 6.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 2.9700 6.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 1.9090 6.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0710 2.0300 6.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 3.2310 5.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 0.7490 7.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 0.1200 7.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 0.4050 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 1.6570 -0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 2.0940 -1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 1.0490 2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 -0.2070 1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 0.9460 2.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 3.7940 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 3.3940 1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 3.3600 1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 3.0130 3.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 5.3610 3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 5.6740 1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3810 6.8020 9.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 8.8270 10.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 10.6420 6.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 8.7270 5.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0910 6.5560 3.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 4.9910 5.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 2.8620 6.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7610 1.2100 6.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6200 3.3030 5.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6210 1.7530 0.9040 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6150 1.5590 0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 51 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 51 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 1 0 0 0 0 10 17 2 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 45 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END