PUBCHEM-ZINC06734294 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 1 0 0 0 0 0999 V2000 0.1310 0.4830 1.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 2.8020 1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 3.1820 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 3.7260 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6470 4.0750 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 3.8800 0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 3.3360 1.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 2.9910 2.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0840 1.0740 1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8090 1.7700 -0.0280 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6650 2.8480 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3030 1.4500 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9970 2.1920 -0.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3430 2.0200 -1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0790 2.7100 -1.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4470 2.5340 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0830 1.6710 -1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3510 0.9830 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9820 1.1520 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5490 1.4850 -1.2720 N 0 3 0 0 0 0 0 0 0 0 0 0 -11.1950 2.0910 -2.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1100 0.7260 -0.5020 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.2800 1.3080 -1.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 0.6640 2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 0.6440 1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -0.5440 1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 2.9060 2.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 3.4560 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 3.8790 -0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9070 4.5000 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6480 4.1510 0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0540 3.1830 2.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7190 2.5700 3.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 1.4090 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 -0.0050 1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4540 0.3830 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6880 1.7220 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5830 3.3840 -2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0210 3.0700 -2.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8500 0.3100 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4110 0.6110 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.3550 -1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 1.4080 1.0780 N 0 0 0 0 0 0 0 0 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 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 23 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 42 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END