PUBCHEM-ZINC06380211 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 0.7420 1.1020 -0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 0.6780 -1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9050 1.7100 -1.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 2.5330 -2.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 1.4920 0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5120 2.8070 1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9100 2.5920 2.7950 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0450 2.8800 3.9380 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1250 2.3020 3.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 2.3020 5.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4040 2.1140 6.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 2.5350 6.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9430 3.8100 7.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 4.2030 7.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 3.3220 7.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 2.0430 7.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 1.6580 6.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 1.0860 7.3580 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4210 1.3610 8.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2090 1.4980 7.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1350 1.8890 4.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1040 1.4810 5.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1350 2.0620 3.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0480 1.7330 2.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 4.3600 4.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 4.7950 4.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 6.1500 4.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 7.0890 4.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4450 6.6750 4.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 5.3210 4.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 0.3800 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 2.0820 -1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 1.1550 0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 0.6260 -2.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 -0.2970 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7320 2.1620 -1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 0.6710 -1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 2.5720 -3.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 3.5620 -2.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 2.1090 -3.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 1.1000 1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8510 0.7240 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 3.5490 1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3750 3.2220 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 4.5060 7.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 5.1960 8.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 3.6630 8.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 0.6550 6.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2400 1.5430 9.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0610 0.4770 7.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9510 2.2010 7.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 1.4690 8.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 4.0810 3.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 6.4730 4.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 8.1440 4.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2420 7.4080 4.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8050 5.0280 4.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 1.7010 -0.7010 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2350 2.6270 -0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 58 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 58 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 5 58 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 10 11 2 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 15 16 2 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 52 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 29 2 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END