PUBCHEM-ZINC04098723 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 0.1280 1.1840 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -0.2130 0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -0.8580 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 -0.1320 -0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 1.2590 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 1.9350 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 3.4020 0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 4.1970 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 5.6610 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 6.2450 0.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 6.2050 0.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 7.6610 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5070 7.9430 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4090 7.5100 0.9360 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4420 7.8080 0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9670 8.1310 2.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 7.8860 2.5450 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3200 6.8230 2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 8.3330 1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 8.5980 3.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 9.5480 3.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4140 6.0870 1.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5390 5.7690 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 8.2070 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 9.3890 -1.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 -0.8460 -0.8800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -2.2220 -0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 1.6750 1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 -0.7890 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2270 1.8250 -0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 3.8400 0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 3.8180 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6620 9.0120 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 7.3920 -1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1630 9.2110 2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5590 7.7250 3.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 8.1220 1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 9.4260 1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1090 -0.2160 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 -2.4200 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 7.4220 -2.2160 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 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 12 13 1 0 0 0 0 12 19 1 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 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 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 26 39 1 0 0 0 0 27 40 1 0 0 0 0 M CHG 1 41 -1 M END