%chk=000221369.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221369

0 1
O -3.432377 0.426632 0.740784
O 1.006881 -1.226390 -0.639031
N -2.700223 -0.029465 -0.226559
N 0.040051 0.290302 0.876800
N 2.173007 0.705053 -0.229370
C -1.734538 1.060161 -0.738207
C -1.865700 -1.239854 0.228408
C -0.759989 1.452158 0.385945
C -0.871189 -0.810038 1.318381
C -3.578547 -0.469480 -1.397264
C 1.084130 -0.159347 -0.039425
C 3.314390 0.184456 -1.038832
C 2.510399 1.766933 0.748423
C 4.222987 -0.762631 -0.259254
H -2.339008 1.944807 -1.029665
H -1.192872 0.702258 -1.634135
H -1.319701 -1.684280 -0.632447
H -2.557639 -2.006163 0.634876
H -0.088344 2.265042 0.043244
H -1.346572 1.840264 1.258784
H -1.430737 -0.428719 2.208761
H -0.264478 -1.683243 1.640857
H -4.192415 0.379817 -1.737058
H -2.998540 -0.865299 -2.236739
H -4.291551 -1.235251 -1.050057
H 2.886944 -0.347880 -1.923707
H 3.885150 1.058597 -1.420685
H 2.425717 2.751538 0.257758
H 3.539183 1.656029 1.130218
H 1.838641 1.755795 1.625877
H 4.652575 -0.293571 0.631771
H 3.668355 -1.653180 0.072383
H 5.052811 -1.113650 -0.883233


%chk=000221369-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221369

0 1
O -3.369539 0.577485 0.904504
O 1.316755 -1.573158 -0.316736
N -2.729522 0.016280 -0.246655
N 0.028689 0.113910 0.710529
N 2.215455 0.579007 -0.133314
C -1.712664 1.028838 -0.813608
C -1.969201 -1.270969 0.144422
C -0.671409 1.348694 0.275430
C -0.915240 -0.915863 1.203904
C -3.773813 -0.303173 -1.298478
C 1.193419 -0.356259 0.055342
C 3.365509 0.167195 -0.973759
C 2.405880 1.762541 0.721326
C 4.448221 -0.613786 -0.195894
H -2.298992 1.927696 -1.065350
H -1.236756 0.607701 -1.720066
H -1.494129 -1.712650 -0.750326
H -2.732198 -1.948541 0.559781
H 0.045167 2.084610 -0.118973
H -1.215696 1.781268 1.134013
H -1.439326 -0.514503 2.088684
H -0.349906 -1.822553 1.468235
H -4.301021 0.635310 -1.525911
H -3.317610 -0.733572 -2.209589
H -4.482298 -1.010530 -0.842969
H 2.975257 -0.469542 -1.785357
H 3.793570 1.082372 -1.426956
H 2.264375 2.711447 0.165533
H 3.432287 1.763104 1.135539
H 1.697813 1.732176 1.564303
H 4.846359 -0.029389 0.654216
H 4.021506 -1.555201 0.188183
H 5.295861 -0.858544 -0.862403


