PUBCHEM-ZINC06468486 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 67 0 0 1 0 0 0 0 0999 V2000 0.0100 1.5030 0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 -0.0070 0.0560 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8610 -0.4280 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 -0.6520 1.2220 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5430 -0.2390 2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -0.2820 1.1750 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9330 -0.4650 -0.1020 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9990 -1.5390 -0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2350 0.1980 -1.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -0.2870 -1.2620 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9600 -1.3710 -1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 0.2930 -2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9400 -0.3070 -2.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 0.2150 -4.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 1.3570 -4.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 1.9460 -4.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 1.4240 -3.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 1.9120 -5.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1850 1.8100 -5.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 0.0790 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1850 -0.1670 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4960 0.3160 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0020 1.0550 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1670 1.3200 0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8550 0.8370 0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3980 1.6000 -0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -2.1860 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 -2.7430 2.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0840 -4.1200 3.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -4.6340 3.9400 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5910 -4.2180 4.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -4.1200 2.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7690 -6.0460 4.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 -6.3270 4.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 2.0090 0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 1.9870 -0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 1.6770 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 -1.1890 -2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 -0.2650 -4.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 2.8230 -4.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 1.9130 -2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 2.9700 -6.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 1.3500 -6.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5760 2.1940 -6.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8090 -0.7330 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1110 0.1050 -2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5230 1.9010 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2300 1.0650 1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8190 1.6860 0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0630 0.9600 -0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 -2.4320 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.7330 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0050 -1.9380 3.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2520 -2.5870 1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4410 -4.7810 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 -4.0840 4.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -4.7050 2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 -4.0520 3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4490 2.9500 -0.7870 N 0 3 0 0 0 0 0 0 0 0 0 0 9.4030 3.3320 -0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8390 3.6080 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1380 2.9340 -1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 -2.7220 2.6230 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8690 -2.1160 3.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 27 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 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 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 59 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 63 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 28 63 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 32 63 1 0 0 0 0 33 34 1 0 0 0 0 59 60 1 0 0 0 0 59 61 1 0 0 0 0 59 62 1 0 0 0 0 63 64 1 0 0 0 0 M CHG 1 59 1 M CHG 1 63 1 M END