PUBCHEM-ZINC05392740 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 0 0 0 0 0999 V2000 -1.2340 1.6440 -0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 0.1860 -0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 -0.3570 1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -1.7060 1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -2.5160 0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 -1.9980 -0.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -0.6490 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.1110 -2.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -0.7480 -3.8800 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 0.2000 -4.9290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 -2.1430 -4.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3970 -0.6710 -3.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1100 0.4480 -4.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 0.4870 -3.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1810 -0.5880 -3.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4480 -1.7090 -2.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0610 -1.7600 -3.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5790 -0.6280 -3.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5080 0.3330 -3.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2940 1.4020 -4.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9080 -0.0760 -3.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -4.2750 0.6850 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 -4.5510 0.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 -4.3250 2.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5590 -4.9960 0.0420 N 0 5 0 0 0 0 0 0 0 0 0 0 -1.4840 -4.8590 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 2.1810 -0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 1.7710 -1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 2.1110 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8010 0.2680 1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -2.1180 2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 -2.6490 -1.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 0.8840 -2.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6030 1.2920 -4.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0260 1.3720 -4.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9450 -2.5640 -2.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5190 -2.6480 -2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9310 -1.4640 -2.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9690 -0.2280 -2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6140 0.7080 -3.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1780 -1.0020 -3.6260 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 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 M CHG 1 25 -1 M END