PUBCHEM-ZINC02972707 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.4090 0.6730 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -0.7530 -0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -1.3000 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 -2.6780 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3360 -3.2340 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4550 -2.4120 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3010 -1.0320 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 -0.4780 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7360 -2.9740 -0.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7690 -1.9290 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1520 -2.5810 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2840 -4.5510 1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9010 -3.8990 1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6620 -4.0960 1.0360 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.8130 -4.6650 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8060 -5.0270 2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1130 -5.6870 2.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.3950 -7.0320 3.1200 S 0 0 0 0 0 0 0 0 0 0 0 0 -11.7290 -7.4020 2.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3050 -7.8940 2.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.2890 -6.4360 4.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6920 -2.9990 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8610 -3.0730 0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7790 -2.0410 0.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5020 -0.9800 1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3790 -0.9420 2.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.4850 -1.9090 1.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 0.9770 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 1.0760 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 1.0550 0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -3.3170 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4540 -4.3070 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1710 -0.3920 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9170 0.5950 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6870 -1.3570 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6340 -1.2650 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9210 -1.8100 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2440 -3.1310 -1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3660 -5.1230 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4190 -5.2160 1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1320 -4.6700 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8090 -3.3490 2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0180 -5.7790 2.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7250 -4.4460 3.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8140 -5.3360 1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0420 -5.6650 4.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4630 -7.2650 5.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2980 -6.0190 5.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0510 -3.9150 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7000 -2.0660 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2120 -0.1710 1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5800 -1.8460 2.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3170 -3.5060 1.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 11 53 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 53 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 14 53 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 27 52 1 0 0 0 0 M END