%chk=000289623.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289623

0 1
S 0.962561 0.350850 1.396459
O -2.289942 2.061192 -0.256568
O 0.393501 1.163313 -1.065357
C -2.633825 0.642955 -0.158747
C -1.417584 1.223088 0.562942
C -2.480667 -0.146371 -1.439037
C -3.875789 0.330379 0.648970
C -2.572850 -1.648990 -1.148030
C -3.956316 -1.176980 0.925183
C -3.853222 -1.990854 -0.372682
C -0.040181 0.996228 0.033589
C 2.523181 -0.108148 0.717152
C 3.154239 0.645393 -0.272034
C 3.122971 -1.242919 1.272112
C 4.422788 0.252069 -0.714687
C 4.393678 -1.619784 0.827734
C 5.042238 -0.874111 -0.164209
H -1.484519 1.462255 1.634129
H -1.528264 0.100127 -1.955825
H -3.275848 0.163807 -2.149280
H -4.768041 0.669637 0.081400
H -3.898101 0.903914 1.595472
H -1.684044 -1.973761 -0.571287
H -2.541620 -2.214895 -2.098538
H -4.904599 -1.410574 1.445093
H -3.144839 -1.472984 1.619299
H -4.739265 -1.798543 -1.008091
H -3.873808 -3.072323 -0.140103
H 2.667731 1.519704 -0.711444
H 2.616515 -1.830594 2.038082
H 4.925780 0.828328 -1.490289
H 4.877786 -2.497731 1.252645
H 6.030955 -1.173876 -0.508752


%chk=000289623-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000289623

0 1
S 1.016021 0.546680 1.568720
O -2.300428 2.126444 -0.321637
O 0.378530 0.961601 -1.112169
C -2.671156 0.664206 -0.218638
C -1.450485 1.208760 0.513328
C -2.541876 -0.157384 -1.493190
C -3.909100 0.350584 0.614986
C -2.598777 -1.672367 -1.159243
C -3.954413 -1.164242 0.951236
C -3.858708 -2.025180 -0.332386
C -0.046945 0.944701 0.057028
C 2.595851 -0.018889 0.808049
C 3.276457 0.764929 -0.151237
C 3.137223 -1.244668 1.260935
C 4.511259 0.306019 -0.664707
C 4.379614 -1.686237 0.751720
C 5.066568 -0.913912 -0.213728
H -1.548458 1.368175 1.596646
H -1.615546 0.100565 -2.032218
H -3.393892 0.107312 -2.151164
H -4.804451 0.625446 0.022112
H -3.924819 0.966058 1.532882
H -1.690762 -1.959223 -0.591345
H -2.581689 -2.254648 -2.099591
H -4.886653 -1.393075 1.501331
H -3.112118 -1.416829 1.626919
H -4.762608 -1.854691 -0.952913
H -3.850482 -3.099537 -0.066723
H 2.850140 1.709656 -0.498125
H 2.594136 -1.844756 1.998467
H 5.037955 0.907106 -1.413732
H 4.803185 -2.632743 1.104857
H 6.027030 -1.260059 -0.611168


