PUBCHEM-ZINC05010547 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 0 0 0 0 0999 V2000 -0.9300 1.4600 4.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 1.1720 2.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 0.4940 2.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 0.2730 0.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0140 -0.3950 0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1140 -0.8580 1.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 -0.6460 2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 0.0260 3.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2620 -1.5470 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3790 -2.8810 0.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5100 -3.5710 0.2610 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.5500 -3.3520 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3650 -5.0840 0.4810 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.9850 -5.6360 -0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9140 -5.3950 1.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6320 -4.2200 2.2380 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.9690 -3.7670 2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7890 -3.2270 1.0490 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.7080 -2.2250 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8330 -3.4960 0.2740 O 0 5 0 0 0 0 0 0 0 0 0 0 -8.8290 -4.6290 2.9440 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6660 -5.6620 2.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6550 -5.8040 3.4680 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.4630 -4.7930 4.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3300 -4.0530 4.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8410 -3.0070 4.7670 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6150 -2.7260 5.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7400 -3.3510 6.2490 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.1880 -4.4090 5.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3310 -5.0620 5.9380 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9360 -5.6080 0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9490 -7.0320 0.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5680 -7.2020 1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 2.0170 4.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 2.0930 4.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 0.5400 4.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 0.6280 0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9610 -0.5460 -0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9850 -1.0070 2.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1630 0.1650 4.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1780 -0.9740 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0900 -1.5840 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4990 -6.2660 1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2930 -1.8860 6.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6610 -5.8500 5.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8060 -4.7340 6.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4560 -5.3680 -0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3280 -5.2120 1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 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 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 31 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 44 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 45 1 0 0 0 0 30 46 1 0 0 0 0 31 32 1 0 0 0 0 31 47 1 0 0 0 0 31 48 1 0 0 0 0 32 33 1 0 0 0 0 M CHG 1 20 -1 M END