PUBCHEM-ZINC05725649 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 1 0 0 0 0 0999 V2000 -0.1010 1.9370 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 0.4790 -0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -0.4240 0.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -0.1970 1.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4670 1.2480 1.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 3.6070 1.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 3.9730 3.1450 P 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 3.4510 3.9380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0450 5.8200 3.1770 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0420 6.0440 2.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 6.3560 4.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 7.7880 4.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 8.2840 3.9590 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 6.4620 2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 6.3280 0.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5520 3.5420 3.5200 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7170 2.5900 -0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 2.1390 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 0.2890 -1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2530 0.2580 0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 -0.8880 1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -0.4520 2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 1.4290 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 1.3430 2.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 3.7980 0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 4.2710 1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 6.2680 4.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 5.7220 5.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 2.2010 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 8.2990 5.9440 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.0360 7.0730 2.6990 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 29 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 4 22 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 M CHG 1 16 -1 M CHG 1 30 -1 M CHG 1 31 -1 M END