PUBCHEM-ZINC00612052 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 31 0 0 0 0 0 0 0 0999 V2000 0.3500 1.3890 -0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 0.0070 -0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -0.6790 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 0.0250 0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 1.4090 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 2.0930 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.4940 0.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 4.1490 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 3.2750 -0.0350 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 5.4920 -0.1720 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 6.1780 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 7.5710 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 8.2180 -0.1370 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 7.5450 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5380 6.1630 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 5.5080 -0.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 -0.8710 1.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6840 -2.1170 0.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 -2.0170 0.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 1.9210 -1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 -0.5390 -1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 1.9570 1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9850 3.9920 0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 5.9800 -0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 8.1210 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4870 8.0770 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4700 5.6170 -0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5070 -2.2170 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 -2.9570 1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 24 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 25 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 M END