%chk=000292180.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292180

0 1
S 1.601566 2.603593 -0.328894
O -3.630297 -0.734287 0.142362
O -2.038907 -2.217347 -0.475767
N 2.145010 -0.808706 -0.336575
N -1.972502 1.388427 0.181643
C 2.145719 -1.099227 1.136704
C 3.085663 -1.724736 -1.066033
C 3.560260 -0.899942 1.704578
C 4.514110 -1.532847 -0.529209
C 4.576403 -1.792221 0.981117
C 0.759738 -0.948495 -0.897783
C -0.095676 0.185412 -0.448430
C 0.255991 1.532062 -0.260745
C -1.484849 0.104204 -0.166621
C -0.914356 2.263377 0.126451
C -0.689846 3.670318 0.345746
C -2.333298 -1.072981 -0.201901
C 0.613603 3.988869 0.131947
C -4.612110 -1.828686 0.153126
C -5.905698 -1.153088 0.553136
H 1.780692 -2.121738 1.372515
H 1.445578 -0.383554 1.621985
H 3.056757 -1.453330 -2.143627
H 2.792471 -2.793732 -0.988548
H 3.558759 -1.111882 2.788578
H 3.851963 0.164071 1.592017
H 4.848066 -0.497062 -0.741878
H 5.206616 -2.203909 -1.067888
H 5.595748 -1.594864 1.360197
H 4.368486 -2.857561 1.194352
H 0.270720 -1.924611 -0.650421
H 0.823345 -0.912802 -2.014003
H -2.930679 1.575708 0.417616
H -1.472700 4.352304 0.638681
H 1.074660 4.959523 0.217294
H -4.634956 -2.265815 -0.860205
H -4.262350 -2.582548 0.879533
H -6.730530 -1.874915 0.598535
H -5.821842 -0.674946 1.538494
H -6.185729 -0.366137 -0.160274


%chk=000292180-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000292180

0 1
S 1.751149 2.344464 -0.156200
O -3.799448 -0.664325 0.125341
O -2.224657 -2.310491 -0.455796
N 2.140062 -0.930902 -0.270313
N -1.979799 1.307539 0.202582
C 2.305721 -1.132166 1.193828
C 3.116235 -1.738934 -1.044754
C 3.727151 -0.742270 1.646318
C 4.562907 -1.364873 -0.664037
C 4.792574 -1.536268 0.855553
C 0.740795 -1.152326 -0.713722
C -0.142400 0.005616 -0.317018
C 0.255451 1.354545 -0.123424
C -1.549145 -0.001203 -0.106635
C -0.880593 2.148299 0.196942
C -0.603749 3.540492 0.416570
C -2.487019 -1.110116 -0.175109
C 0.749544 3.807133 0.263359
C -4.859244 -1.711159 0.083576
C -6.184761 -1.013558 0.374142
H 2.106986 -2.201858 1.469550
H 1.554578 -0.513236 1.717209
H 2.946550 -1.551167 -2.121777
H 2.964107 -2.836934 -0.868271
H 3.829433 -0.925693 2.733367
H 3.866088 0.342309 1.473557
H 4.741630 -0.309756 -0.948155
H 5.268953 -1.993723 -1.240211
H 5.810808 -1.203863 1.133415
H 4.720041 -2.612414 1.118647
H 0.304534 -2.105786 -0.335664
H 0.748098 -1.235316 -1.819425
H -2.954756 1.533123 0.392143
H -1.342321 4.303253 0.671074
H 1.255224 4.766581 0.367724
H -4.842222 -2.187200 -0.913655
H -4.616366 -2.484151 0.835298
H -7.007236 -1.751743 0.356271
H -6.171068 -0.536001 1.369126
H -6.398241 -0.240021 -0.383621


