PUBCHEM-ZINC04701094 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 0 0 0 0 0 0999 V2000 0.1320 1.2000 0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -0.0340 -0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -1.1220 0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -0.5490 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 -0.6170 -1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 -1.0880 -1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9890 -1.4940 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2600 -1.4250 1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9610 -0.9580 1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3020 -1.9710 -0.1190 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6490 -3.1860 -0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3530 -4.3950 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8980 -4.2540 1.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5950 -5.6310 -0.4880 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4150 -6.7420 0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3090 -6.8220 1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1330 -7.9240 1.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0560 -8.9580 1.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1600 -8.8970 1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3550 -7.7850 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5360 -7.7100 -0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6890 -6.7530 -1.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4670 -1.1620 0.7360 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.3540 -2.1830 1.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7360 -0.3790 1.6700 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2750 -0.1000 -0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 1.5720 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 1.9750 0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 0.9320 1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 0.2340 -1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -1.3900 1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 -2.0010 -0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 -0.7500 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6610 -0.3000 -2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9740 -1.1400 -2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7080 -1.7400 1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 -0.9080 1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7090 -3.1690 -1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0600 -3.2340 -1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8940 -5.7470 -1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5850 -6.0210 1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2700 -7.9820 2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9090 -9.8160 2.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8760 -9.7050 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8300 -0.7170 -1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9600 0.5820 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5200 0.4750 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4470 -8.7030 -0.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2050 -8.6100 -1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 48 49 1 0 0 0 0 M END