PUBCHEM-ZINC06068769 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 0 0 0 0 0 0999 V2000 -0.0790 1.5720 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 0.0750 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.6180 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -2.0230 1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -2.7040 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -1.9100 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -0.5550 -1.2790 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -4.2100 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -4.6190 -1.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -6.2400 -1.8570 P 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -6.7470 -1.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -2.7630 2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -2.1180 3.5080 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -3.0320 4.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -2.3520 5.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -1.1370 5.9310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -3.3450 6.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 0.1030 2.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 1.9870 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 1.9410 -1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 1.9410 0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.3550 -2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -4.5800 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -4.6250 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -3.8660 2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -3.9420 6.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -2.8120 7.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 -3.9860 6.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -0.5460 3.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -6.3540 -3.3740 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4190 -6.6790 -1.1730 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 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 30 1 0 0 0 0 10 31 1 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 18 29 1 0 0 0 0 M CHG 1 30 -1 M CHG 1 31 -1 M END