%chk=000235448.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235448

0 1
S 3.193868 0.394694 0.241770
N -1.903274 0.376513 0.352778
N -0.007966 1.656317 0.576630
N -0.832966 -1.829239 -0.108023
N 1.647182 -1.649728 -0.116542
N 0.550271 -3.727123 -0.391143
C -0.826559 -0.487875 0.163432
C 0.364755 0.329956 0.305808
C 1.603816 -0.331333 0.145555
C -1.344867 1.671499 0.602107
C -3.324858 0.025679 0.309524
C 0.437241 -2.358049 -0.213982
C 2.912539 2.136795 0.577358
H -1.970072 2.533415 0.784988
H -3.446267 -1.060155 0.114198
H -3.815729 0.253705 1.272356
H -3.841533 0.575591 -0.497083
H -0.269035 -4.255112 -0.649782
H 1.449983 -4.110698 -0.642991
H 2.371045 2.299838 1.520856
H 2.324891 2.626986 -0.212425
H 3.892837 2.625124 0.643707


%chk=000235448-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000235448

0 1
S 3.255772 0.381846 0.237657
N -1.904158 0.375491 0.351987
N -0.025505 1.683307 0.564569
N -0.859728 -1.807864 -0.095008
N 1.597023 -1.667410 -0.123297
N 0.488934 -3.691994 -0.492994
C -0.816093 -0.478940 0.161524
C 0.352578 0.346545 0.294943
C 1.591193 -0.334648 0.134622
C -1.366337 1.653249 0.590126
C -3.314809 -0.023922 0.306262
C 0.400308 -2.344713 -0.226265
C 2.958839 2.211563 0.600316
H -2.000918 2.517904 0.773487
H -3.347905 -1.108592 0.115484
H -3.815238 0.188114 1.267037
H -3.847601 0.500342 -0.506144
H -0.361094 -4.240188 -0.580363
H 1.408388 -4.111093 -0.595234
H 2.421524 2.330786 1.549271
H 2.380399 2.672743 -0.209705
H 3.969732 2.644274 0.660823


