%chk=000281520.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281520

0 1
S -4.222075 0.798632 -0.185673
O 2.724524 0.006532 1.304908
O 4.211086 1.855148 -0.821372
O 3.194000 -1.359806 -1.677941
O 5.640525 -2.146337 1.197806
N 0.869616 0.693388 0.040217
N -0.226965 2.676848 1.075138
N -2.662198 2.617102 0.950611
N -2.508935 -2.225485 -1.708263
C 2.281572 0.992436 0.369220
C 3.177500 0.878459 -0.900762
C 3.881890 -0.494167 -0.766698
C 3.598756 -0.974695 0.675508
C 4.852388 -1.011900 1.563261
C -0.239355 1.462296 0.442388
C 0.383787 -0.466361 -0.602042
C -1.439408 0.774769 0.022995
C -1.007036 -0.433771 -0.635219
C -2.649751 1.429554 0.322449
C -1.456933 3.200547 1.297276
C -1.839420 -1.413323 -1.226923
C -4.423459 -0.637406 0.928755
C -5.746074 -1.197031 0.526980
C -5.886960 -2.144143 -0.399680
H 2.353226 1.970297 0.911514
H 2.616226 0.965697 -1.855945
H 4.964107 -0.435655 -1.010983
H 3.042588 -1.936347 0.683753
H 4.581390 -1.035926 2.634028
H 5.525596 -0.149860 1.382423
H 1.064522 -1.215573 -0.998940
H 3.923894 2.698552 -1.238936
H 3.809807 -2.025353 -2.054778
H 5.281778 -2.962807 1.604430
H -1.513077 4.178219 1.804104
H -3.595081 -1.360026 0.802397
H -4.412741 -0.307171 1.984983
H -6.605955 -0.768611 1.048101
H -6.846713 -2.547631 -0.691023
H -5.059242 -2.584792 -0.945968


%chk=000281520-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000281520

0 1
S -4.346464 0.954005 -0.488848
O 2.606874 -0.365881 1.370665
O 4.278147 1.797161 -0.327020
O 3.210079 -1.424906 -1.584756
O 6.205686 -1.477122 1.248844
N 0.811784 0.482646 0.003635
N -0.199650 2.450821 1.044902
N -2.612506 2.626240 0.723223
N -2.422369 -2.098690 -2.463269
C 2.182469 0.722042 0.481152
C 3.246903 0.811102 -0.656136
C 3.949825 -0.563745 -0.645558
C 3.818006 -1.039427 0.819002
C 5.048132 -0.671513 1.674584
C -0.280947 1.287834 0.352745
C 0.357021 -0.566190 -0.790759
C -1.471076 0.714541 -0.218193
C -1.033326 -0.460402 -0.962168
C -2.671255 1.438935 0.051285
C -1.402684 3.081952 1.168601
C -1.795848 -1.345346 -1.775434
C -4.454385 -0.921706 -0.007540
C -5.678346 -1.118765 0.838000
C -6.753334 -1.850430 0.444878
H 2.125385 1.657867 1.065778
H 2.783321 1.010442 -1.639824
H 5.007197 -0.457903 -0.945257
H 3.624278 -2.128101 0.871735
H 4.810049 -0.813828 2.746281
H 5.336486 0.376666 1.500945
H 1.059127 -1.294338 -1.195732
H 3.903156 2.711237 -0.394176
H 3.747379 -2.230418 -1.784777
H 6.145021 -2.379631 1.651324
H -1.406117 4.043566 1.688249
H -4.477851 -1.503275 -0.939781
H -3.525654 -1.141503 0.544960
H -5.675753 -0.628202 1.820924
H -7.624397 -1.981770 1.095954
H -6.786963 -2.339668 -0.536338


