PUBCHEM-ZINC03871595 MOE2007 3D CORINA 3.40 0006 02.08.2006 72 74 0 0 1 0 0 0 0 0999 V2000 3.2720 0.7970 0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 -0.3610 0.6960 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4510 0.0530 1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 -1.4430 1.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 -2.7990 1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 -3.2690 0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 -2.2510 -1.0640 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7490 -2.6370 -1.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -0.9170 -0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7640 -2.0670 -1.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8210 -2.1820 -1.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 -4.6040 -0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 -4.9350 -1.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 -5.6890 0.6700 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5850 -5.4940 1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -5.7960 0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -6.8180 2.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 -6.8900 2.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7170 -8.1440 4.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8390 -7.5200 3.6210 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.7440 -7.7130 4.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8030 -6.8460 2.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 -9.0530 5.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 -9.5530 5.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7100 -9.2600 5.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 -6.9690 0.0610 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9750 -7.6070 0.5060 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3210 -8.5960 -0.4970 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8700 -6.5170 0.8320 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5520 -8.4700 2.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7990 -7.8240 3.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4210 -8.4320 4.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 -9.6800 4.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 -10.3460 3.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9740 -9.7500 1.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 -10.4160 0.7540 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9580 -11.6210 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -12.5020 1.9030 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2940 -12.7770 1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9240 -11.7030 3.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 -13.7840 1.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 0.4800 -0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 1.6100 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6290 1.2030 1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 -1.5360 1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9010 -1.1410 2.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7760 -3.5240 2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -2.7430 1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -1.0840 -0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 -0.1730 -1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -4.8180 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -6.0730 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -7.8150 1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -6.5610 2.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 -5.9150 2.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 -7.1930 1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 -7.0230 -0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2760 -6.8460 3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6100 -7.9360 5.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 -10.1470 5.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1910 -10.0500 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -11.3500 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 -12.1590 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 -12.2770 4.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -11.5480 3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 -14.3630 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 -14.4140 2.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 -13.5680 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 -1.6560 -2.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6980 -1.5510 -3.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 -7.8830 3.4880 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -8.4080 3.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 45 1 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 5 47 1 0 0 0 0 5 48 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 49 1 0 0 0 0 9 50 1 0 0 0 0 10 11 2 0 0 0 0 10 69 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 53 1 0 0 0 0 17 54 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 18 71 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 19 71 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 26 27 1 0 0 0 0 26 57 1 0 0 0 0 27 28 2 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 58 1 0 0 0 0 32 33 1 0 0 0 0 32 59 1 0 0 0 0 33 34 2 0 0 0 0 33 60 1 0 0 0 0 34 35 1 0 0 0 0 34 40 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 36 61 1 0 0 0 0 37 38 1 0 0 0 0 37 62 1 0 0 0 0 37 63 1 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 38 41 1 0 0 0 0 40 64 1 0 0 0 0 40 65 1 0 0 0 0 41 66 1 0 0 0 0 41 67 1 0 0 0 0 41 68 1 0 0 0 0 69 70 1 0 0 0 0 71 72 1 0 0 0 0 M CHG 1 20 1 M END