PUBCHEM-ZINC00691887 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 1.3160 1.5260 2.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 0.0970 2.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 -0.5080 1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 0.0570 0.3730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -1.9720 1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -2.7520 0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -4.1510 0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -4.8140 1.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -4.0090 2.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 -2.6080 2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -6.2450 1.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 -6.9590 2.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 -6.5650 3.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 -8.4040 2.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 -8.5230 0.8670 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1340 -9.0770 0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 -7.0900 0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -6.8050 -0.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -9.6020 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6490 -10.4610 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -9.3780 2.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5980 -8.5300 2.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 -10.4350 1.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9240 -9.3410 1.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5670 -8.2170 0.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2670 -7.5460 0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 1.8830 2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 1.9030 2.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 1.8960 1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 -2.2800 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 -4.6910 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 -4.4380 2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 -2.0360 2.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5300 -8.6280 1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -9.0490 2.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 -10.1820 -0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 -8.7120 -0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2060 -10.6290 -0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 -11.4230 0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5690 -10.3130 2.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5300 -8.8090 3.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 -7.5680 1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 -8.3240 3.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7940 -11.1660 2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1420 -10.9470 0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9330 -9.6780 1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9000 -9.0230 2.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -9.2200 1.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5640 -9.7400 1.1430 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.8780 -8.8500 0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 48 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 48 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 49 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 49 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 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END