PUBCHEM-ZINC05568569 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 42 0 0 0 0 0 0 0 0999 V2000 -0.0700 1.4040 -0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 0.0120 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -0.6750 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 0.0550 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3430 1.4560 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 2.1230 -0.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6330 2.2250 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1420 2.5130 -1.3420 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3710 3.1160 -1.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1080 3.4150 -0.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7030 3.3580 -2.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0090 4.1170 -3.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3540 4.4110 -4.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5480 3.9750 -5.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 -2.1760 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -2.7670 -1.3240 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 -4.1310 -1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 -4.9110 -0.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -4.5480 -2.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 -6.0590 -3.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -6.5130 -4.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -5.6030 -5.4600 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 1.9290 -0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -0.5380 -0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2970 -0.4740 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 3.2080 -0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4890 3.1760 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3940 1.6680 0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 2.2670 -2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7540 2.3840 -3.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8730 3.9190 -3.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9620 5.0730 -2.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8370 3.5450 -2.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -2.5290 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -2.5500 0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -2.1680 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -4.1390 -3.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 -4.0820 -3.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 -6.4600 -2.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 -6.5190 -2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4240 5.0650 -4.7830 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2500 -7.7690 -4.7410 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 M CHG 1 41 -1 M CHG 1 42 -1 M END