PUBCHEM-ZINC03752591 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 0.3070 1.6790 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3790 0.1830 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -0.4580 1.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -1.8250 1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 -2.4090 2.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 -3.7970 2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -4.6210 1.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -4.0360 0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -2.6460 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -6.0680 1.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -7.0860 1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -8.3240 1.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -9.6820 1.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -10.6830 2.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 -10.3100 2.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8800 -8.9790 2.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9470 -8.0150 2.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0840 -6.6560 2.0670 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9390 -6.1520 2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -12.1360 2.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 -12.4110 2.0720 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.4620 -6.9290 1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6680 -6.3550 -0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0480 -6.9240 -1.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 2.0420 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 2.2200 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 1.9160 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 -0.1540 -0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -0.0250 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -1.7780 3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -4.2340 3.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -4.6650 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 -2.2450 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 -9.9580 1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1630 -11.0750 2.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8950 -8.7110 2.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -7.8960 1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9610 -6.2890 1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -12.9790 2.7500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -5.3750 -0.3830 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 39 2 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 M CHG 1 21 -1 M CHG 1 40 -1 M END