PUBCHEM-ZINC06358190 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 0.0640 2.0180 0.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 0.4900 0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -0.1390 1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 0.0580 0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -1.4380 0.5090 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3830 -1.6180 0.3940 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8930 -0.7100 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5820 -2.7240 -0.6390 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5170 -2.5760 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 -2.5830 -1.5550 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6370 -1.7770 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 -3.7780 -2.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 -3.8140 -3.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 -4.8970 -4.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -5.9560 -4.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -5.9550 -2.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 -4.8660 -1.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 -7.0710 -2.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -7.1390 -0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -7.0400 -4.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 -5.0150 -5.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 -3.9490 -6.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7790 -3.9580 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 -5.1130 -0.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1230 -3.5340 1.4730 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0820 -2.1690 1.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5490 -1.4950 2.5140 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5140 -4.4340 2.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -2.3200 1.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 -3.4010 1.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 2.3600 0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 2.5010 -0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 2.3690 1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 0.2170 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 0.0190 2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 -1.2120 1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 0.3000 1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 0.3960 1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 0.6320 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 -2.9720 -4.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -4.8520 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 -7.1340 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -8.0880 -0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 -6.3320 -0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4560 -7.6230 -4.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0290 -3.8240 -6.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4700 -3.0180 -6.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2010 -4.2070 -7.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8300 -5.2880 2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5130 -3.9240 3.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5210 -4.8040 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2820 -1.9940 -0.7700 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 -2.7640 -0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -1.8750 2.8520 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 52 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 26 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 52 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 40 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 26 27 2 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 2 0 0 0 0 29 54 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 54 -1 M END