%chk=000280913.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280913

0 1
S -1.427880 1.227055 0.270338
O -3.415215 -2.063759 0.728518
O -4.330693 1.845513 -0.707822
N 0.862210 -0.204292 0.036472
N -1.217264 -1.414823 0.387798
C -2.987574 0.329716 0.541824
C -0.485265 -0.332866 0.231522
C -2.610479 -1.186182 0.573398
C -3.620086 0.731206 1.853014
C -3.857345 0.736967 -0.659420
C 1.798727 -1.313916 0.010628
C 1.384274 1.149420 -0.146466
C -4.058743 -0.294511 -1.719046
C 3.125262 -1.073153 0.416397
C 1.821714 1.538164 -1.421603
C 1.400597 -2.588294 -0.421138
C 1.446577 2.023408 0.949608
C 4.048074 -2.119171 0.381202
C 2.317392 2.832417 -1.596943
C 2.340430 -3.622436 -0.442607
C 1.941545 3.315171 0.750975
C 3.661240 -3.393762 -0.047176
C 2.374676 3.719536 -0.516294
H -2.929617 0.636308 2.702006
H -3.976390 1.774413 1.828984
H -4.495278 0.098661 2.077583
H -3.113105 -0.624992 -2.171842
H -4.553250 -1.198271 -1.319937
H -4.693159 0.088216 -2.533661
H 3.436436 -0.087627 0.760233
H 1.772948 0.842821 -2.259851
H 0.368079 -2.790719 -0.721131
H 1.116777 1.704216 1.939152
H 5.076383 -1.939491 0.694692
H 2.656912 3.151442 -2.582831
H 2.032879 -4.616155 -0.770614
H 1.988344 4.009460 1.590583
H 4.386097 -4.205394 -0.068304
H 2.756969 4.729704 -0.662842


%chk=000280913-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000280913

0 1
S -1.506279 1.341459 0.240606
O -3.476704 -2.103691 0.708749
O -4.992100 1.352526 -0.631071
N 0.816302 -0.189822 0.077963
N -1.246692 -1.387284 0.408634
C -3.100375 0.309374 0.516823
C -0.545543 -0.275956 0.243039
C -2.630919 -1.187840 0.556115
C -3.794547 0.695827 1.832391
C -4.010714 0.576279 -0.726414
C 1.741207 -1.314375 0.056767
C 1.374129 1.154927 -0.087292
C -3.661383 -0.148947 -2.012768
C 3.128376 -1.040624 -0.099126
C 1.520686 1.691620 -1.385626
C 1.306807 -2.661469 0.185209
C 1.762689 1.892423 1.053036
C 4.060632 -2.097967 -0.127556
C 2.055377 2.989667 -1.542157
C 2.255354 -3.705492 0.153418
C 2.296889 3.190019 0.889367
C 3.633767 -3.438719 -0.002560
C 2.443139 3.738916 -0.406310
H -3.092786 0.638028 2.680854
H -4.213424 1.712502 1.764449
H -4.626844 -0.008638 2.007952
H -2.570717 -0.179410 -2.180472
H -4.013940 -1.195620 -1.935621
H -4.163617 0.332277 -2.865723
H 3.485766 -0.012791 -0.196926
H 1.216883 1.098084 -2.253983
H 0.244054 -2.871850 0.310746
H 1.642967 1.452615 2.048414
H 5.124524 -1.866257 -0.247819
H 2.165853 3.414172 -2.545425
H 1.903780 -4.738231 0.253740
H 2.594642 3.769438 1.769440
H 4.360771 -4.257305 -0.025204
H 2.855190 4.746135 -0.530263


