PUBCHEM-ZINC06232837 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 0.5780 1.5060 -1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 0.2910 -0.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 0.1910 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 -1.1580 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -1.8670 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -0.9860 -0.9880 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -1.3610 -1.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9430 -1.4330 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9270 -2.2290 -2.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3140 -2.3130 -1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8690 -0.9290 -1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9050 -0.1270 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5150 -0.0410 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 -3.2960 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -4.1600 0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -5.7640 0.4320 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -5.1860 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 -3.8880 -0.3470 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -6.1280 -0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 -6.6100 -1.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 -7.4910 -2.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 -7.9530 -3.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -8.8580 -4.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7810 -9.3070 -3.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0080 -8.8500 -2.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1240 -7.9430 -1.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 1.2570 0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7790 2.4370 0.1530 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3880 1.9280 -2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 1.3200 -2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 2.2640 -0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9080 -1.5380 1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -0.6710 -2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 -2.3290 -2.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -1.9640 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0090 -1.7590 -3.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5480 -3.2450 -2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9970 -2.8370 -2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2580 -2.9070 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0580 -0.3870 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8320 -1.0280 -0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3010 0.8830 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8280 -0.5940 0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 0.4930 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 0.5560 -1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0480 -3.9470 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 -6.9560 0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1650 -5.5790 -0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 -7.6030 -4.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 -9.2120 -5.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4700 -10.0120 -3.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8760 -9.2010 -1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3410 -7.6110 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8290 0.9230 1.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 2 0 0 0 0 M CHG 1 28 -1 M END