%chk=000270859.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270859

0 1
S -0.606577 3.066195 -0.270062
O 1.603564 -0.791832 1.119132
O 2.876241 1.973568 -0.232750
O 2.022727 -1.235279 -1.875081
O 4.957031 0.467624 0.639958
O -4.695224 -1.220153 -0.543085
N -0.341853 0.332332 0.327574
N -2.441882 0.934137 -0.373515
N -0.828928 -2.097909 0.777878
N -3.103701 -2.770114 0.302965
C 1.090166 0.500365 0.644550
C 1.952323 0.897680 -0.605113
C 2.758501 -0.392749 -0.931137
C 2.932572 -1.062599 0.445038
C 4.123081 -0.523475 1.303707
C -1.140791 -0.813100 0.371252
C -1.204488 1.364535 -0.124249
C -2.425967 -0.443949 -0.070101
C -3.510342 -1.438918 -0.144327
C -1.884266 -3.024083 0.722139
C -2.187072 3.844867 -0.942366
H 1.201265 1.266317 1.436399
H 1.330355 1.189615 -1.467722
H 3.714775 -0.165104 -1.419535
H 2.972192 -2.160244 0.350076
H 4.808285 -1.354149 1.539171
H 3.700723 -0.144894 2.259473
H 2.485409 2.857204 -0.442884
H 1.183217 -1.566595 -1.461296
H 0.089325 -2.297951 1.184853
H 4.400740 1.267347 0.406689
H -1.624757 -4.033554 1.064393
H -1.928739 4.891833 -1.160631
H -2.971035 3.772200 -0.177259
H -2.492873 3.305328 -1.848628


%chk=000270859-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270859

0 1
S -0.549347 3.053545 -0.055079
O 1.601638 -0.919543 1.014646
O 2.745929 1.954799 -0.459899
O 2.189989 -1.396391 -1.879427
O 4.884933 0.637951 0.649727
O -4.756755 -1.106514 -0.400326
N -0.346270 0.285637 0.374227
N -2.452513 0.979669 -0.208814
N -0.879016 -2.152142 0.703396
N -3.188280 -2.738290 0.283998
C 1.103159 0.397796 0.585701
C 1.910441 0.779044 -0.713337
C 2.826871 -0.452956 -0.959761
C 2.998382 -1.051065 0.450777
C 4.042256 -0.316120 1.355720
C -1.171692 -0.839837 0.382894
C -1.195870 1.362892 0.014187
C -2.463059 -0.413752 0.015957
C -3.574889 -1.374882 -0.068403
C -1.960630 -3.047056 0.636684
C -2.030962 3.876859 -0.883934
H 1.302277 1.153490 1.372635
H 1.248245 0.943604 -1.580491
H 3.776965 -0.173020 -1.431865
H 3.180021 -2.136519 0.408420
H 4.741774 -1.051971 1.783165
H 3.491594 0.156818 2.197815
H 2.189302 2.774836 -0.509838
H 1.376653 -1.780053 -1.458073
H 0.050014 -2.402366 1.053931
H 4.313911 1.383708 0.301423
H -1.715207 -4.081509 0.907016
H -1.819028 4.956020 -0.863256
H -2.928760 3.629226 -0.302379
H -2.128076 3.502586 -1.911928


