PUBCHEM-ZINC05141255 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 0.0980 1.7080 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 0.3450 -0.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -0.2490 -1.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -1.5990 -1.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -2.3280 -2.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 -1.7280 -3.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 -0.3650 -3.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 0.3670 -2.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 -2.4900 -4.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 -3.8320 -4.5580 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 -4.5760 -5.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7480 -3.9220 -6.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8880 -2.5530 -6.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 -1.7800 -5.3460 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 -2.1760 -7.2390 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1080 -3.3080 -7.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5090 -4.3820 -7.4640 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2530 -0.8290 -7.4970 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5320 -0.1250 -7.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7140 -0.5860 -7.0280 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2840 -1.5090 -7.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1860 0.4310 -8.0800 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2750 0.4560 -8.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4730 -0.0290 -9.3400 C 0 0 3 0 0 0 0 0 0 0 0 0 7.0280 -0.8490 -9.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2090 -0.6050 -8.9320 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2000 1.0740 -10.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6040 0.5060 -11.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8790 -0.0570 -11.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7680 1.7410 -7.6750 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6920 1.5810 -6.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7390 0.0040 -5.8370 O 0 5 0 0 0 0 0 0 0 0 0 0 2.6600 -5.9360 -5.5530 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 1.8300 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 2.3480 -0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 2.0220 0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 -2.0940 -0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -3.3790 -2.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 0.1500 -3.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 1.4130 -2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7930 -3.2850 -8.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4960 1.8170 -9.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1240 1.5760 -10.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0380 -6.3440 -4.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1200 -6.4880 -6.2640 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 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 26 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 32 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 30 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 30 31 1 0 0 0 0 33 44 1 0 0 0 0 33 45 1 0 0 0 0 M CHG 1 32 -1 M END