PUBCHEM-ZINC03686933 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 -0.0050 1.2230 -0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -0.1700 -0.8570 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -0.6970 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 0.0230 0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 -0.6420 1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 -2.0290 0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -2.7580 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -2.0870 -0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6470 -4.2050 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 -4.9870 -0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1430 -6.3570 -0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 -7.5970 -0.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1240 -8.7970 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1880 -8.7640 0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 -7.5470 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2070 -6.3660 0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9210 -5.0560 0.9290 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 -4.7570 1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6540 -9.9280 -0.9090 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2310 -11.1770 -0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 -4.4900 -1.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6370 -4.1370 -3.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6010 -3.5870 -4.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8590 -3.2040 -5.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 1.4730 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 1.8140 -1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 1.4760 0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2540 1.1020 0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1380 -0.0780 1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3440 -2.5340 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -2.6440 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3300 -7.6300 -1.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 -9.6750 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9840 -7.5310 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 -11.3240 -0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 -11.2680 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7520 -11.9680 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1290 -5.2500 -1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9020 -3.6110 -1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 -3.3940 -2.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1300 -5.0270 -3.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3660 -4.3400 -4.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1220 -2.7090 -3.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1330 -2.4040 -5.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3600 -4.0640 -5.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8340 -2.6960 -6.3910 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.3690 -2.4540 -7.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3180 -1.8530 -6.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5490 -3.4030 -6.6080 H 0 0 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 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 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 46 49 1 0 0 0 0 M CHG 1 46 1 M END