PUBCHEM-ZINC02046831 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 0 0 0 0 0 0999 V2000 -0.3260 1.2230 -0.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 2.0080 -1.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 2.5580 -1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 3.2680 -2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 3.4000 -3.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 2.8210 -3.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 2.1540 -2.7500 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5130 4.0760 -5.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 4.1460 -6.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 2.9570 -7.2000 P 0 0 0 0 0 0 0 0 0 0 0 0 -2.9100 3.1360 -7.8730 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2100 3.7920 -2.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2240 4.0500 -1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6560 5.1240 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7130 5.9370 0.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9820 2.4240 -0.4170 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9080 0.3240 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 0.9020 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 1.8340 0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 2.8370 -4.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4090 3.5590 -5.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7840 5.1090 -4.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3020 4.7380 -3.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8530 3.0350 -3.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5000 3.0440 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6940 4.2730 -2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 1.7130 -2.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 3.2810 -8.0570 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.4190 1.6810 -6.3770 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.7400 4.0560 -1.2800 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.2350 3.3490 -0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4230 4.9630 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8400 5.0580 0.3620 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 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 16 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 20 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 13 26 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 M CHG 1 7 1 M CHG 1 16 -1 M CHG 1 28 -1 M CHG 1 29 -1 M CHG 1 30 1 M CHG 1 33 -1 M END