%chk=000181420.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181420

0 1
S -0.038697 -0.113074 -1.507357
O -0.120297 1.139828 -2.232296
O -0.267682 -1.364554 -2.215566
O -2.500791 2.027002 0.134069
O -0.413839 1.889614 0.975150
C -1.319710 -0.029196 -0.212216
C -2.653677 -0.410234 -0.884254
C -0.976235 -1.032547 0.905680
C -3.793502 -0.583236 0.129148
C -2.119388 -1.178745 1.920498
C -3.426002 -1.586268 1.228509
C -1.324786 1.364421 0.366153
C 1.479224 -0.230667 -0.699852
C 2.157107 -1.457954 -0.694636
C 2.068905 0.888033 -0.100846
C 3.400922 -1.574135 -0.079285
C 3.315875 0.779159 0.517040
C 3.991502 -0.451820 0.531812
C -2.554993 3.416264 0.566443
C 5.318636 -0.573967 1.202001
H -2.522518 -1.357854 -1.454541
H -2.937660 0.368693 -1.623858
H -0.053151 -0.716121 1.436097
H -0.766463 -2.026089 0.455042
H -4.708192 -0.913542 -0.398126
H -4.037583 0.401104 0.580555
H -2.263589 -0.226143 2.467084
H -1.842699 -1.929490 2.684745
H -4.243473 -1.651835 1.970479
H -3.323380 -2.599978 0.794878
H 1.708148 -2.330992 -1.185624
H 1.551635 1.857272 -0.104440
H 3.919150 -2.530752 -0.077857
H 3.761857 1.654133 0.986694
H -1.939116 4.016299 -0.111870
H -2.203070 3.508891 1.598798
H -3.619347 3.652550 0.468166
H 5.895398 0.361179 1.165473
H 5.194553 -0.832495 2.265460
H 5.948129 -1.354751 0.752748


%chk=000181420-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000181420

0 1
S -0.071256 0.137673 -1.480364
O -0.090304 1.654008 -2.099576
O -0.303697 -1.173059 -2.440831
O -2.522338 2.218562 -0.092326
O -0.762689 1.870712 1.391360
C -1.569004 0.008271 0.002029
C -2.802350 -0.454926 -0.772231
C -1.067453 -1.014094 1.023254
C -3.943085 -0.818006 0.220907
C -2.213849 -1.367995 2.014279
C -3.475999 -1.856495 1.266343
C -1.564626 1.432218 0.526766
C 1.596871 -0.117409 -0.631594
C 2.179875 -1.392946 -0.701807
C 2.223545 0.985987 -0.028334
C 3.457438 -1.566341 -0.125137
C 3.498925 0.784582 0.543031
C 4.129893 -0.487910 0.509440
C -2.454950 3.669935 0.204952
C 5.491766 -0.692327 1.147971
H -2.522587 -1.348059 -1.364457
H -3.137975 0.325409 -1.474405
H -0.197502 -0.617229 1.573922
H -0.758692 -1.935739 0.491275
H -4.801431 -1.208352 -0.357437
H -4.290627 0.101038 0.732953
H -2.459666 -0.474181 2.621506
H -1.850176 -2.142245 2.715960
H -4.288633 -2.059016 1.989999
H -3.251774 -2.815529 0.755896
H 1.662465 -2.205018 -1.223278
H 1.741041 1.967331 -0.019717
H 3.940886 -2.548830 -0.176494
H 4.011512 1.629236 1.017555
H -1.509137 4.075229 -0.190995
H -2.509237 3.842809 1.292714
H -3.319163 4.103612 -0.316288
H 6.103224 0.225492 1.100755
H 5.388803 -0.963167 2.216778
H 6.053157 -1.505230 0.655724


