PUBCHEM-ZINC03080782 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 0 0 0 0 0 0999 V2000 -0.0480 1.3740 -0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 0.2660 -1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -0.4100 -0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 0.0250 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 1.1310 0.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 1.8050 0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8760 -0.8740 0.3270 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0880 0.4810 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5060 -0.0860 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5450 1.0310 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9700 0.4740 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0060 1.5920 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4310 1.0360 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4670 2.1540 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8920 1.5980 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9280 2.7160 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3500 2.1630 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4610 3.2110 -0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0950 4.4130 -0.4830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 1.8990 -0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -0.0750 -2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -1.2750 -1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 1.4720 1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 2.6640 1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9120 1.0090 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9530 1.1890 0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6790 -0.6250 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6410 -0.8040 -0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3790 1.5740 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4180 1.7510 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1350 -0.0700 1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0970 -0.2450 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8400 2.1370 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8790 2.3110 0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5970 0.4900 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5590 0.3180 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3010 2.7000 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3400 2.8710 0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0580 1.0510 0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0190 0.8800 -0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7590 3.2640 -1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7990 3.4340 0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5160 1.6170 0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4760 1.4470 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6300 2.7280 -0.3490 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 M CHG 1 45 -1 M END