PUBCHEM-ZINC06308032 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 0.0300 1.1640 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -0.3600 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -0.7190 1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.1820 2.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 -0.5490 2.7230 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1730 -0.4600 1.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3730 -0.1890 1.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -0.9040 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6880 -1.9270 3.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 -2.7900 3.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0430 -2.2020 3.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1820 -3.6630 4.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5670 -4.0040 4.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6870 -4.2960 4.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6880 -4.5450 4.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2290 -4.4250 6.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8800 -4.0830 6.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0940 -4.8960 4.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4220 -4.4430 3.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3310 -4.8320 2.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9310 -4.3640 2.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0560 -4.1190 1.7660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 0.5120 3.4660 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 1.1270 4.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 2.5450 4.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 2.5830 3.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -1.0190 -1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 1.5590 -0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 1.4200 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 1.6990 0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -1.8060 1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7750 -0.3140 1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9570 -0.5760 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -2.0010 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 -1.5410 4.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8200 -1.9480 3.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9000 -4.3260 3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4730 -3.8790 5.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2260 -5.9800 4.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7710 -4.4120 5.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3870 -4.8610 2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5300 -3.3500 3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2980 -5.9210 2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5710 -4.3890 1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 0.1670 3.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 0.5200 5.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 1.2010 5.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 -0.6580 -1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -2.1080 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -0.7980 -2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 3.4940 4.9160 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 23 2 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 45 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 17 2 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 18 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 M CHG 1 51 -1 M END