%chk=000067071.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000067071

0 1
 S    1.759700      -2.564100      0.2323000    
 S   -2.695800       2.354300     -3.0700000E-02
 O   0.9398000      -2.802500      -1.159800    
 O   -1.848900       2.442700       1.363000    
 O    2.959800      -3.381900      0.1681000    
 O   0.8268000      -2.692800       1.338300    
 O   -1.754800       2.567100      -1.118100    
 O   -3.881600       3.182600      0.1034000    
 O    5.793000       2.215000     -0.2371000    
 O    6.235900      6.6299997E-02 -0.3141000    
 N    5.423800       1.016300     -0.2015000    
 N   -6.468300      -1.121000      0.1511000    
 C    1.312400      0.1528000      0.3155000    
 C   -2.368100     -0.3628000     -0.3524000    
 C    2.255400     -0.8836000      0.1847000    
 C   -3.249100      0.6936000     -0.1207000    
 C  -8.9500003E-02 -9.3699999E-02  0.4918000    
 C  -0.9382000     -0.1460000     -0.5331000    
 C    3.610400     -0.5990000      1.4500000E-02
 C    1.769600       1.481600      0.2701000    
 C   -4.610900      0.4419000      4.6900000E-02
 C   -2.848800      -1.670600     -0.4171000    
 C    4.044800      0.7258000     -2.7799999E-02
 C   -5.091500     -0.8659000     -1.7600000E-02
 C    3.124400       1.766100      0.1000000    
 C   -4.210300      -1.922300     -0.2495000    
 H  -0.4352000     -0.2096000       1.515500    
 H  -0.5996000     -3.0300001E-02  -1.559300    
 H    4.326500      -1.409100     -8.8000000E-02
 H    1.074700       2.312800      0.3614000    
 H   -5.317500       1.246400      0.2319000    
 H   -2.176500      -2.506300     -0.5973000    
 H    3.426500       2.809900      7.0299998E-02
 H   -4.572700      -2.945700     -0.3021000    
 H   -6.816600      -2.069400      0.1052000    
 H   -7.108400     -0.3563000      0.3199000    
 H    1.457000      -2.656000      -1.986400    
 H  -0.8856000       2.257600       1.296000    


%chk=000067071-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000067071

0 1
S 2.234493 -2.933458 0.089177
S -3.180626 2.734956 -0.113043
O 1.694520 -3.087057 -1.684281
O -2.600295 2.887087 1.645593
O 3.644662 -3.696295 0.290749
O 0.974850 -3.345816 1.021094
O -1.943265 3.152360 -1.072137
O -4.595622 3.500830 -0.280472
O 5.914265 2.294956 -0.114188
O 6.537890 0.097831 -0.007676
N 5.646087 1.031023 -0.059819
N -6.554220 -1.196991 0.051513
C 1.462256 -0.129907 -0.047165
C -2.409970 -0.064736 -0.002971
C 2.539957 -1.066296 0.005892
C -3.486734 0.865184 -0.033885
C 0.060964 -0.538206 -0.039420
C -1.005493 0.330399 -0.018466
C 3.897721 -0.735369 0.000131
C 1.871771 1.244323 -0.115910
C -4.844731 0.544913 -0.015859
C -2.834575 -1.433667 0.057644
C 4.224117 0.633084 -0.056225
C -5.220653 -0.828831 0.035894
C 3.217542 1.626060 -0.120744
C -4.179730 -1.808727 0.077780
H -0.126228 -1.614797 -0.031658
H -0.814397 1.407473 -0.022565
H 4.682233 -1.497997 0.043780
H 1.106166 2.021804 -0.181434
H -5.595180 1.342743 -0.046548
H -2.074099 -2.218620 0.104773
H 3.513117 2.676902 -0.176383
H -4.443633 -2.871138 0.130203
H -6.824732 -2.176326 0.091916
H -7.292717 -0.498291 0.027424
H 1.605736 -4.063283 -1.890623
H -2.428847 3.857776 1.825206


