PUBCHEM-ZINC05838358 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -2.0480 0.5090 -0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7250 -0.9640 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -1.0650 0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -2.5380 1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -2.6390 1.9750 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7380 -2.0760 2.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2070 -2.0540 1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 -2.9520 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 -2.4140 -0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 -3.2470 -1.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8400 -4.6280 -1.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2490 -5.1780 -0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -4.3440 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 -4.8760 1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -4.0430 2.3200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -4.7920 3.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -4.4970 4.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 -5.5390 5.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -6.8220 5.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -7.1360 4.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -6.1020 3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 -6.0810 2.0570 N 0 3 0 0 0 0 0 0 0 0 0 0 2.6880 -7.2340 1.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 -5.2980 6.3710 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 -6.4010 7.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 -2.7090 -2.9670 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9850 -3.6200 -3.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 1.0010 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8910 0.5820 -1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3050 0.9960 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5940 -1.4550 0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -1.4500 -1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -0.5740 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 -0.5790 1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 -3.0290 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -3.0240 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 -1.0910 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9720 -1.8980 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3830 -1.3420 -1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -5.2680 -2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2150 -6.2500 -0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 -3.5020 4.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -7.5970 5.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 -8.1370 3.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7350 -7.1950 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2370 -8.1540 1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 -7.2100 0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -7.1900 6.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 -6.7820 7.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1380 -6.0720 8.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7640 -4.2250 -3.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1900 -4.2700 -4.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4090 -3.0610 -4.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 22 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 M CHG 1 22 1 M END