%chk=000273908.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273908

0 1
S 1.381142 0.730126 -1.657580
O -0.023039 0.641893 -0.716421
O -0.551590 -1.738285 0.720071
O 1.459039 2.088146 -2.132227
O 1.274967 -0.353713 -2.607543
C -1.044618 -0.314483 -1.073526
C -1.567822 -0.785560 0.306139
C -2.069488 0.373784 -1.984846
C -2.929049 -1.486964 0.276424
C -2.423462 1.817835 -1.605797
C -3.723855 -1.343244 1.580247
C -3.180782 1.976930 -0.281871
C -3.966402 0.107201 2.021888
C -4.519155 1.228015 -0.243017
C -4.985629 0.889446 1.180668
C 2.578075 0.431284 -0.469182
C 2.404625 -0.603741 0.457802
C 3.733593 1.222244 -0.424966
C 3.390363 -0.861339 1.411095
C 4.721033 0.969070 0.524786
C 4.556775 -0.079077 1.449526
C 5.621513 -0.364384 2.454842
H -0.573617 -1.184039 -1.601903
H -1.544487 0.068923 1.027443
H -2.994063 -0.242369 -2.024154
H -1.666576 0.373768 -3.020692
H -2.784121 -2.559059 0.037343
H -3.545704 -1.075421 -0.560847
H -3.012720 2.265723 -2.429502
H -1.481841 2.408745 -1.545545
H -3.199311 -1.880640 2.394753
H -4.697079 -1.860751 1.460916
H -3.350335 3.053475 -0.088050
H -2.525024 1.631389 0.548171
H -2.998657 0.658862 2.021925
H -4.308650 0.103117 3.075969
H -4.437757 0.284358 -0.828709
H -5.297570 1.826506 -0.752477
H -5.231440 1.830089 1.713828
H -5.933923 0.320687 1.121838
H -0.808008 -2.160872 1.559088
H 1.482818 -1.209527 0.448651
H 3.861044 2.048104 -1.134358
H 3.251785 -1.670966 2.124767
H 5.618537 1.583733 0.551521
H 6.180972 0.536379 2.743648
H 5.221894 -0.803122 3.379689
H 6.353898 -1.081074 2.049977


%chk=000273908-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000273908

0 1
S 1.556603 0.392790 -1.841555
O 0.040751 0.689628 -0.753607
O -0.537538 -1.657919 0.730718
O 1.877901 1.725377 -2.702773
O 1.311479 -1.017100 -2.612137
C -1.115061 -0.182071 -1.090917
C -1.611523 -0.732189 0.268314
C -2.100335 0.616153 -1.981426
C -2.960957 -1.491268 0.200725
C -2.551437 2.020004 -1.496132
C -3.797558 -1.443589 1.509669
C -3.379010 2.096878 -0.185027
C -4.208336 -0.041719 2.039774
C -4.719737 1.313206 -0.199847
C -5.200960 0.801443 1.189626
C 2.830285 0.228647 -0.476101
C 2.597489 -0.708041 0.543769
C 3.969993 1.043995 -0.553434
C 3.594513 -0.835870 1.535603
C 4.948035 0.889799 0.453531
C 4.780760 -0.053459 1.501631
C 5.856559 -0.234463 2.556663
H -0.738317 -1.051803 -1.673336
H -1.667331 0.106057 0.987132
H -2.976245 -0.020539 -2.211422
H -1.581747 0.757152 -2.950406
H -2.730161 -2.545397 -0.051820
H -3.579031 -1.109825 -0.624631
H -3.140104 2.475068 -2.319235
H -1.645961 2.644971 -1.375778
H -3.235829 -1.958425 2.320291
H -4.713460 -2.049036 1.351285
H -3.586443 3.164844 0.028101
H -2.745664 1.754666 0.652329
H -3.301198 0.558204 2.250355
H -4.684044 -0.198301 3.029581
H -4.651423 0.461162 -0.899347
H -5.515147 1.963468 -0.617138
H -5.486611 1.681142 1.803436
H -6.132245 0.215171 1.043705
H -0.824397 -2.047612 1.595074
H 1.658661 -1.274292 0.581623
H 4.080613 1.772659 -1.362605
H 3.444944 -1.551853 2.352107
H 5.850255 1.511115 0.422015
H 6.421834 0.698310 2.725574
H 5.428895 -0.557775 3.521466
H 6.584540 -1.008162 2.244381


