PUBCHEM-ZINC05764903 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 37 0 0 1 0 0 0 0 0999 V2000 -0.0230 1.8190 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 P 0 0 3 0 0 0 0 0 0 0 0 0 0.9030 -0.6210 1.5120 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -0.5230 -1.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9860 0.0360 -1.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 -0.6860 -3.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7410 -0.0880 -3.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1780 -0.8090 -4.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7300 -0.1040 -5.4250 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -0.5610 0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1270 -0.4580 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 0.6850 1.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4750 0.7880 2.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 -0.2470 3.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 -1.3870 3.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0430 -1.4970 2.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5730 -2.5120 4.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 -3.5480 3.8200 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.9730 -2.0460 5.5330 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.8560 -2.9890 4.6480 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.0590 -0.1340 4.9870 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.6910 0.8700 5.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9810 -1.0440 5.7920 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0000 2.1960 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1800 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1700 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8460 1.0960 -1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7520 -0.0840 -1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 -1.7460 -2.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 -0.5660 -3.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6010 0.9720 -3.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5070 -0.2070 -2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3180 -1.8690 -4.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4120 -0.6900 -5.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9170 1.4940 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0360 1.6780 3.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -2.3890 1.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END