PUBCHEM-ZINC05625583 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -0.6320 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 0.0160 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 -2.1080 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -2.8550 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 -4.2340 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -4.8870 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 -4.1530 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -2.7590 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7300 -4.8010 0.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 -5.8110 -0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2220 -6.5030 -0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3020 -6.0830 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1450 -5.1460 0.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4700 -6.7560 0.0830 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1930 -6.4910 0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6440 -7.7890 -0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1470 -8.6080 -0.7600 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.6810 -8.2010 -1.5970 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4660 -7.5820 -1.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5140 -8.0060 -2.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9410 -9.3350 -2.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5150 -8.8320 -3.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6720 -8.5030 -4.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1980 -8.0420 -6.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5680 -7.9110 -6.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4110 -8.2410 -5.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8840 -8.7070 -3.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0820 -7.4600 -7.3370 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 -2.3520 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -4.8060 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -5.9660 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3950 -2.1870 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1510 -6.1340 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6700 -7.5320 -2.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0090 -9.8650 -2.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6520 -10.0130 -2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6040 -8.6050 -4.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5390 -7.7840 -6.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4800 -8.1390 -5.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5410 -8.9680 -3.1190 H 0 0 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 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 21 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 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 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 44 1 0 0 0 0 29 45 1 0 0 0 0 M END