%chk=000293514.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000293514

0 1
S 1.438537 1.590348 1.313686
F -2.625897 1.356243 -2.185892
F -3.526308 2.287454 -0.510612
F -4.694086 1.108924 -1.822329
F -3.529673 0.679466 1.926630
F -3.941545 -1.372193 1.585773
F -5.291974 0.106704 0.904735
O -3.676143 -1.257937 -1.138557
O 2.113107 -3.299834 1.037067
N 2.408457 -1.115600 0.426851
C -3.219126 -0.158116 -0.370997
C -1.736840 -0.387829 -0.154758
C 0.998095 -0.890412 0.223055
C 0.438304 0.355567 0.568722
C -0.913405 0.619681 0.372246
C -1.189912 -1.638587 -0.486232
C -3.504807 1.141350 -1.202314
C -3.982210 -0.170572 0.999979
C 0.169811 -1.892251 -0.308689
C 3.303463 -0.022147 0.128838
C 2.964317 1.289057 0.505685
C 2.863540 -2.348307 1.011561
C 4.499662 -0.252885 -0.571879
C 3.821460 2.355489 0.239708
C 5.361856 0.816874 -0.826529
C 5.034124 2.113020 -0.414121
C 4.246728 -2.366517 1.580178
H -1.311419 1.602264 0.636692
H -1.837374 -2.424031 -0.894503
H 0.583405 -2.875785 -0.556151
H -4.659177 -1.267154 -1.262018
H 4.749215 -1.251008 -0.927608
H 3.550452 3.371614 0.533607
H 6.295576 0.637977 -1.361029
H 5.716055 2.938217 -0.615577
H 4.568563 -1.404935 2.006426
H 4.992986 -2.665949 0.829627
H 4.301281 -3.115198 2.390627


%chk=000293514-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000293514

0 1
S 1.447900 1.510619 1.615676
F -2.752489 0.891099 -2.507422
F -3.100887 2.283465 -0.759452
F -4.840856 1.151962 -1.678082
F -3.699662 1.186650 1.674175
F -3.705336 -1.067495 1.865159
F -5.403635 -0.027575 0.793433
O -3.800998 -1.347968 -1.027894
O 2.112426 -3.356567 1.147665
N 2.427392 -1.133051 0.485127
C -3.241168 -0.187698 -0.369269
C -1.743711 -0.430111 -0.142984
C 1.016346 -0.921512 0.251077
C 0.425733 0.285178 0.704319
C -0.943067 0.543061 0.500951
C -1.163542 -1.634985 -0.599052
C -3.471565 1.047644 -1.315954
C -3.998131 -0.009705 0.997914
C 0.212233 -1.874048 -0.415033
C 3.310141 -0.028579 0.184179
C 2.986527 1.272132 0.645577
C 2.883332 -2.362928 1.045732
C 4.460043 -0.208695 -0.621890
C 3.831557 2.366543 0.364080
C 5.319671 0.878498 -0.886347
C 5.012107 2.165190 -0.385031
C 4.317041 -2.415238 1.561258
H -1.363058 1.492270 0.844772
H -1.790704 -2.375170 -1.098809
H 0.660516 -2.807208 -0.758120
H -4.775774 -1.223403 -1.177352
H 4.674669 -1.199143 -1.035412
H 3.561667 3.366238 0.719432
H 6.215588 0.724833 -1.496489
H 5.672501 3.012600 -0.595447
H 4.700317 -1.437122 1.890568
H 4.999429 -2.811315 0.787821
H 4.326544 -3.125462 2.403023


