PUBCHEM-ZINC05599707 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 0 0 0 0 0 0999 V2000 0.0390 0.9660 1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 1.2690 3.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 3.0900 1.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 3.4070 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 4.8370 -0.0700 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 5.6180 -0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 5.3360 -1.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 6.4010 -2.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 7.7020 -2.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 7.9600 -1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 6.9040 -0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 6.7710 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 5.5170 0.4850 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 8.8040 -2.8090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 8.7830 -3.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0010 7.8030 -3.9620 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 10.1090 -4.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2200 10.1840 -5.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 11.4060 -5.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5890 12.5490 -5.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1910 12.4750 -3.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 11.2440 -3.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2340 13.6490 -3.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 13.5870 -1.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0270 13.7550 -5.6860 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 14.4630 -6.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0750 11.5920 -7.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2160 10.4390 -8.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.0990 1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 1.4630 2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 1.0840 0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 1.7370 3.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 0.1820 3.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5550 1.6590 3.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 3.5410 2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 3.4540 2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 3.0210 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 2.9630 -0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 4.3350 -1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0380 6.1690 -2.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 8.9620 -1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0320 7.5390 0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 9.6930 -2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2270 9.2750 -6.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 11.1490 -2.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 13.2880 -1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6880 12.9200 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1200 14.5920 -1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 14.6880 -5.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3180 15.4130 -6.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 13.9090 -7.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 10.7620 -9.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9250 9.7270 -7.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2450 9.9690 -8.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 1.5860 1.9120 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0160 1.1390 1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 55 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 55 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 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 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END