PUBCHEM-ZINC02046989 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 0 0 0 0 0 0 0 0999 V2000 -0.5320 0.8180 -0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 1.8150 -1.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3030 2.3840 -1.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6170 3.2880 -2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 3.5810 -3.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 2.9980 -3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 2.1350 -2.5790 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9790 4.4620 -4.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 4.1360 -5.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 2.6830 -6.7110 P 0 0 0 0 0 0 0 0 0 0 0 0 -2.9150 2.3160 -6.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0370 3.8420 -2.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2990 3.9960 -1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7810 3.4780 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9600 3.1960 -2.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6870 5.5110 -1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7630 5.8380 -2.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1530 2.0930 -0.6410 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.1520 -0.0830 -0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 0.5160 -0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 1.2500 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 3.1510 -4.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0380 4.4500 -5.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 5.4950 -4.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0330 4.8870 -3.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5620 3.2170 -3.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5730 2.4070 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2920 3.9980 0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8620 3.6180 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0490 3.1650 -2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7740 3.6450 -3.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6050 2.1590 -2.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 1.6670 -2.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 2.9830 -8.1880 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4140 1.7860 -6.1060 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.7980 3.8190 -1.4920 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.4190 2.9630 -0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4470 4.6060 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8280 6.2240 -0.8470 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 13 36 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 M CHG 1 7 1 M CHG 1 18 -1 M CHG 1 34 -1 M CHG 1 35 -1 M CHG 1 36 1 M CHG 1 39 -1 M END