%chk=000234762.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234762

0 1
S 0.377145 -1.882784 0.113385
S 3.564269 0.892905 -1.362141
O 0.154065 -2.999215 -0.784390
O 0.901404 -2.112253 1.429648
N 1.669091 -1.066892 -0.813597
N -4.215311 1.780757 0.089747
N 1.666635 1.023670 0.412901
N 2.327275 2.192779 0.487849
C -0.929961 -0.820766 0.106302
C -1.916172 -0.924289 -0.893972
C -1.056685 0.171196 1.100262
C -3.120461 0.933833 0.085555
C -3.001715 -0.067532 -0.919287
C -2.135535 1.041039 1.101004
C 2.156909 0.168569 -0.515067
C 3.338409 2.331735 -0.341648
H -1.823824 -1.702561 -1.663138
H -0.290623 0.258398 1.885641
H 2.134446 -1.595496 -1.566235
H -3.757348 -0.160543 -1.693172
H -2.214894 1.805053 1.870006
H -4.870458 1.785301 -0.671352
H -4.267100 2.554513 0.729071
H 3.981241 3.195081 -0.425872


%chk=000234762-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000234762

0 1
S 0.439291 -1.677606 -0.010447
S 4.178351 0.636465 -1.193000
O 0.193147 -2.992260 -0.935469
O 1.105560 -1.779227 1.461113
N 1.655306 -0.680354 -1.182655
N -4.631197 1.581614 0.162585
N 1.976037 1.206179 0.253888
N 2.931462 2.162438 0.615845
C -1.096376 -0.647319 0.030119
C -2.152884 -1.018609 -0.823567
C -1.163444 0.445652 0.915900
C -3.458191 0.843434 0.114948
C -3.339336 -0.270412 -0.774128
C -2.353389 1.187041 0.956268
C 2.420913 0.331296 -0.665204
C 4.082301 2.041046 -0.030086
H -2.048338 -1.880205 -1.490430
H -0.301514 0.716851 1.531785
H 2.068010 -1.357846 -1.837357
H -4.180444 -0.544330 -1.420820
H -2.430555 2.044817 1.633470
H -5.420524 1.350105 -0.434253
H -4.722560 2.377099 0.788561
H 4.919178 2.726631 0.094433


