%chk=000194354.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194354

1 1
O 1.032231 2.208894 -0.158580
N 2.476962 -0.397987 -0.106781
N 3.567128 -0.625066 -0.202685
C -1.110198 -0.668230 -0.600379
C -1.048170 0.727494 0.183890
C 0.102717 -1.267700 0.230243
C -1.123598 0.266232 1.676711
C -0.362773 -1.084694 1.697642
C 0.446500 1.041540 -0.010112
C 1.170030 -0.162187 0.006017
C -2.412817 -1.425691 -0.408845
C -0.826800 -0.540852 -2.091324
C -1.996430 1.813838 -0.221353
H 0.418793 -2.278198 -0.049151
H -2.179575 0.146890 1.983837
H -0.696142 1.003378 2.373585
H 0.476877 -1.079880 2.410985
H -1.015798 -1.919146 2.014015
H -3.239413 -0.955809 -0.961894
H -2.335304 -2.455942 -0.788184
H -2.742686 -1.503334 0.633817
H 0.109592 -0.038141 -2.344295
H -0.783095 -1.532276 -2.570131
H -1.632571 0.001727 -2.608052
H -1.961400 2.693863 0.434872
H -1.860339 2.142869 -1.261225
H -3.043230 1.456738 -0.168088
H 0.380309 2.996968 -0.162135


%chk=000194354-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000194354

1 1
O 1.034747 2.240898 -0.134336
N 2.470185 -0.321765 -0.053120
N 3.624416 -0.490779 -0.108793
C -1.105685 -0.680439 -0.608684
C -1.030319 0.728614 0.156747
C 0.099965 -1.293688 0.218008
C -1.097405 0.256091 1.684835
C -0.368624 -1.128368 1.703987
C 0.440492 1.039633 -0.022335
C 1.142848 -0.179703 0.001304
C -2.439269 -1.428266 -0.395596
C -0.842745 -0.580699 -2.129346
C -2.003756 1.843595 -0.224861
H 0.429716 -2.301742 -0.071921
H -2.160583 0.174979 1.966608
H -0.636350 0.994867 2.362424
H 0.473545 -1.158990 2.414190
H -1.053125 -1.948762 1.973449
H -3.243728 -0.941700 -0.974746
H -2.350811 -2.462257 -0.774947
H -2.766590 -1.485272 0.653899
H 0.105782 -0.077773 -2.389261
H -0.814720 -1.590439 -2.575167
H -1.661023 -0.031802 -2.627858
H -1.895776 2.734550 0.424339
H -1.894166 2.155535 -1.279361
H -3.041747 1.495400 -0.091220
H 0.395525 3.003582 -0.165838