PUBCHEM-ZINC05114542 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 0.1020 1.4260 -0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -0.0380 0.0050 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7100 -0.2680 1.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -0.1520 2.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 0.0840 3.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -0.3430 2.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 -0.4440 3.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6590 -0.6320 2.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 -0.6520 1.6270 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 -0.4700 1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 -0.4040 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1580 -0.5680 -1.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6510 -0.8430 0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7410 -0.4840 1.8800 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.6830 -1.0080 1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0960 -0.8050 3.2680 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4700 -0.1680 4.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3070 -2.1680 3.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 -0.3900 5.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 0.9590 5.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7730 1.0550 6.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 0.1290 7.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 2.3450 7.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 -0.5500 1.3220 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 1.7050 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 1.6170 -1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 2.0930 0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6350 -0.1870 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6850 -1.8980 0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7830 -2.3730 4.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0540 -0.8280 5.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 -0.9850 5.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 3.0680 6.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 2.5780 8.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 -0.5890 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 -0.6730 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0420 0.9910 1.7880 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.7390 1.2740 2.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4260 1.2430 0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2030 1.5700 1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 24 2 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 8 2 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 37 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 33 1 0 0 0 0 23 34 1 0 0 0 0 24 35 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 37 40 1 0 0 0 0 M CHG 1 37 1 M END