%chk=000281343.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281343

0 1
S 3.420873 -1.036211 -0.168061
O 3.832162 -2.060481 -1.094735
O 3.844744 -1.141517 1.233807
N 3.950838 0.475100 -0.710230
N -2.515986 -0.595122 -0.398711
N -3.169518 0.145315 0.357452
N 5.040143 2.558222 -0.663716
N 5.693413 0.891871 0.926639
N -5.746960 -0.595057 2.435988
N -5.466495 2.445142 -0.639531
C 1.691211 -0.877294 -0.213415
C 0.974963 -0.807146 0.984098
C 1.029755 -0.826021 -1.443564
C -1.074083 -0.627628 -0.277782
C -0.416105 -0.677750 0.962157
C -0.361427 -0.703672 -1.487208
C 4.858549 1.246619 -0.150141
C -4.666778 0.074990 0.143578
C -5.269777 -0.291352 1.431296
C -5.112849 1.406406 -0.285545
H 1.502815 -0.854177 1.946374
H 1.595688 -0.888230 -2.380510
H -0.980835 -0.615446 1.893752
H -0.886736 -0.670790 -2.442802
H 5.986568 2.918874 -0.679532
H 4.547025 2.742167 -1.537147
H 5.407066 0.078409 1.498691
H 6.147582 1.617528 1.463045
H -4.981146 -0.690050 -0.642547


%chk=000281343-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000281343

0 1
S 3.446649 -0.878676 -0.121392
O 3.882923 -1.991867 -1.224884
O 3.839832 -1.127272 1.469971
N 3.891177 0.827043 -0.655463
N -2.611036 -0.468093 -0.517926
N -3.277411 0.010056 0.485177
N 5.562229 2.425767 -0.770887
N 5.774813 0.783634 0.908818
N -6.050551 -1.508385 1.923869
N -5.611891 2.552547 0.130413
C 1.569645 -0.718473 -0.204569
C 0.887289 -0.229233 0.925346
C 0.938028 -1.133783 -1.386104
C -1.185611 -0.527317 -0.329627
C -0.513622 -0.131523 0.861988
C -0.467560 -1.032909 -1.443272
C 5.064708 1.293820 -0.151017
C -4.778324 0.016258 0.140093
C -5.493550 -0.811619 1.134284
C -5.254197 1.416305 0.149331
H 1.443280 0.042566 1.827964
H 1.528364 -1.535477 -2.215258
H -1.095875 0.241713 1.709390
H -1.025605 -1.335785 -2.334289
H 6.146939 3.087734 -0.264224
H 5.100402 2.727952 -1.626499
H 5.342421 0.018072 1.454981
H 6.747168 1.044014 1.059058
H -4.925936 -0.414372 -0.873573


