%chk=000189976.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189976

0 1
O 1.989093 -0.201204 -0.679277
O 1.715713 2.426146 -0.123671
O -2.831929 2.153319 0.311128
O 2.163071 -0.600394 1.580926
N 0.729433 0.350325 -0.509039
N -0.585223 2.267809 0.076143
N -0.187994 -1.876109 -0.378745
N -2.744710 -0.729414 0.088085
C -0.358524 -0.511702 -0.284296
C -1.641341 0.059424 -0.030513
C 0.713079 1.758138 -0.149437
C -1.822466 1.525120 0.131823
C -1.291348 -2.633376 -0.249737
C -2.577596 -2.056339 -0.024192
C 2.657051 -0.675613 0.493444
C 3.951745 -1.199743 -0.000602
H -0.648317 3.289299 0.232616
H -1.155854 -3.722116 -0.322395
H -3.473479 -2.682732 0.072018
H 4.069956 -1.093148 -1.094544
H 4.795061 -0.668337 0.474292
H 4.056077 -2.272052 0.238873


%chk=000189976-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189976

0 1
O 1.981103 -0.206822 -0.716698
O 1.709829 2.482786 -0.208509
O -2.916259 2.161508 0.366830
O 2.248602 -0.583616 1.602870
N 0.709981 0.356009 -0.377834
N -0.610069 2.253259 0.061271
N -0.194756 -1.838298 -0.380659
N -2.783601 -0.725535 0.092343
C -0.391340 -0.494731 -0.255500
C -1.685446 0.072019 -0.008355
C 0.689360 1.762185 -0.174667
C -1.843015 1.548192 0.159180
C -1.305873 -2.614651 -0.273329
C -2.595880 -2.066063 -0.044931
C 2.713369 -0.676532 0.464861
C 4.025374 -1.240295 -0.005377
H -0.664375 3.268978 0.194729
H -1.155191 -3.694666 -0.365811
H -3.481838 -2.701960 0.033246
H 4.129981 -1.159927 -1.096389
H 4.848581 -0.695440 0.487624
H 4.092962 -2.299099 0.298006


