PUBCHEM-ZINC04097444 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 1 0 0 0 0 0999 V2000 -0.1720 1.6060 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 0.0950 -0.0410 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4830 -0.1060 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 -0.5250 -0.1500 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0710 -0.1970 0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -2.0560 -0.1560 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8330 -2.4130 -0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8630 -2.6140 -0.2810 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4190 -2.4470 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6070 -1.9960 -1.4700 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6590 -2.3060 -1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4950 -0.4590 -1.4420 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8800 -0.0600 -2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 -0.0760 -1.3570 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2670 0.0030 -0.3490 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 1.5960 -0.2800 P 0 0 0 0 0 0 0 0 0 0 0 0 -5.2140 1.9050 -1.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0520 -2.5510 -2.6750 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9170 -3.4970 -2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 -4.0370 -0.4770 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 -4.3410 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 -2.5820 1.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 -1.9420 1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 -0.4990 1.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 0.1670 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 2.0580 0.4410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 3.0260 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 2.1300 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 1.8490 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6560 1.6600 0.8530 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.3180 2.2830 0.0360 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 24 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 22 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 M CHG 1 30 -1 M CHG 1 31 -1 M END