PUBCHEM-ZINC01137964 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 -4.3810 1.4580 1.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3790 -0.0490 1.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1950 -0.6600 2.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 -0.7790 0.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 -0.0770 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -0.7650 -0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -2.1480 -0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 -2.8560 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3770 -2.1760 0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 -4.2550 0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5890 -4.9380 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6460 -4.3420 0.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 -6.4410 0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9430 -6.9400 0.3220 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7340 -7.1750 -0.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4300 -8.5490 -1.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1740 -9.6360 -1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8950 -10.8960 -1.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8720 -11.0690 -2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1290 -9.9810 -2.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4100 -8.7210 -2.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6020 -7.2400 1.8110 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.6420 -8.1860 1.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5110 -7.4630 2.6940 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3790 -5.7520 2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7050 -5.5150 2.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3150 -4.3480 2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6000 -3.4180 3.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2740 -3.6560 3.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6650 -4.8250 3.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1810 1.8170 2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4230 1.8210 1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5400 1.8270 0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 1.0030 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -0.2210 -1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -2.6800 -1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1000 -2.7250 1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -4.7340 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0990 -6.8610 -0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0060 -6.7360 1.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7950 -7.1060 -0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4810 -6.4260 -1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9730 -9.5010 -0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4760 -11.7460 -1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6540 -12.0530 -2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3290 -10.1160 -3.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8320 -7.8700 -2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2640 -6.2410 1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3510 -4.1620 2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0760 -2.5060 3.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7150 -2.9290 4.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6310 -5.0120 3.3280 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 2 0 0 0 0 2 4 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 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 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 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 M END