%chk=000261141.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261141

0 1
S 2.082187 0.719310 0.683417
S 3.987450 -1.208159 -0.374729
S 5.020645 1.179030 0.831342
O -0.402910 0.751654 0.265221
O -3.377966 -0.678654 -0.022617
O -2.595909 1.361382 0.679663
O -0.519571 -2.663634 -0.177191
O 4.829546 2.428363 1.553592
C -2.097804 -0.943434 0.559825
C -1.116332 -1.416719 -0.540466
C 0.013857 -0.355320 -0.581850
C -1.573629 0.440726 1.033946
C 1.343934 -0.829483 0.008275
C -3.540681 0.761805 -0.246715
C 2.289254 -1.433042 -1.004260
C -4.932720 1.135208 0.206119
C -3.174526 1.112016 -1.673752
C 3.750746 0.314949 0.424568
H -2.268224 -1.693416 1.352578
H -1.635142 -1.524170 -1.517188
H 0.126601 0.097368 -1.591168
H -1.331048 0.637112 2.090205
H 1.166491 -1.538060 0.857690
H 2.112080 -2.521754 -1.128650
H 2.201787 -0.972132 -2.006584
H -5.686633 0.911455 -0.557618
H -5.211974 0.583964 1.116493
H -4.988906 2.206679 0.447409
H -2.085291 1.214291 -1.788722
H -3.529916 0.350305 -2.377150
H -3.605021 2.076616 -1.973840
H -1.171777 -3.391558 -0.278343


%chk=000261141-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000261141

0 1
S 2.306109 0.997816 0.332676
S 3.942779 -1.413089 -0.707863
S 5.228726 1.405464 -0.378427
O -0.610721 0.351382 1.060775
O -3.017511 -0.530075 -0.790071
O -2.977771 1.002206 1.020801
O -0.406668 -2.708470 0.760844
O 4.634045 2.859082 0.234602
C -2.331320 -1.186348 0.335036
C -0.963212 -1.706434 -0.155522
C -0.076041 -0.437966 -0.078288
C -2.009511 -0.029717 1.322015
C 1.406306 -0.705145 0.196527
C -3.434670 0.859673 -0.387636
C 2.059773 -1.523105 -0.922259
C -4.958745 0.956486 -0.395680
C -2.732187 1.870571 -1.296923
C 3.863385 0.335343 -0.266957
H -2.969336 -1.977338 0.770969
H -1.040932 -2.096849 -1.188124
H -0.195611 0.137751 -1.018142
H -2.094113 -0.231494 2.398668
H 1.520647 -1.202570 1.171425
H 1.794147 -2.588433 -0.828872
H 1.813639 -1.140576 -1.926750
H -5.341203 0.838391 -1.423658
H -5.393377 0.169318 0.241706
H -5.274390 1.940633 -0.009260
H -1.640903 1.835897 -1.150077
H -2.967324 1.655787 -2.353531
H -3.076543 2.890813 -1.056759
H -0.978867 -3.516304 0.758253


