%chk=000262516.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262516

0 1
O -5.067203 1.157467 1.709966
O 5.677160 1.594142 0.040581
O 5.845230 -0.120399 1.351755
N -1.080151 -0.480869 -0.105646
N -3.096973 -0.260627 -1.634343
N -2.089905 0.274852 1.810956
N -5.051904 0.614450 -0.525289
N 5.244097 0.576315 0.552449
C -0.077155 -1.093092 -1.012745
C 1.317869 -0.669937 -0.571033
C -2.408282 -0.173275 -0.422886
C -0.261157 -2.610954 -1.059055
C -3.017299 0.302784 0.768005
C -0.950197 -0.197570 1.299902
C 1.861832 0.507944 -1.108410
C 2.057570 -1.426870 0.349238
C 3.142772 0.922437 -0.742617
C 3.340786 -1.023840 0.721146
C -4.422923 0.738530 0.788756
C 3.876362 0.147719 0.167499
C -4.465200 0.174608 -1.589319
H -0.260713 -0.682486 -2.048218
H -0.226058 -3.069291 -0.060114
H 0.519913 -3.089101 -1.665317
H -1.231031 -2.891643 -1.489475
H -0.018506 -0.345789 1.825019
H 1.284852 1.114176 -1.809123
H 1.637296 -2.337176 0.781800
H -2.656913 -0.610433 -2.473785
H 3.578744 1.840792 -1.154570
H 3.930760 -1.608658 1.437472
H -4.989772 0.101692 -2.555802


%chk=000262516-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000262516

0 1
O -5.083232 1.659930 1.246675
O 5.340784 2.054831 0.192187
O 6.172945 -0.057276 0.424331
N -1.160422 -0.604846 0.017410
N -2.869603 -0.162995 -1.775036
N -2.296142 0.356394 1.761996
N -4.841942 1.015403 -1.013802
N 5.205512 0.772335 0.221576
C -0.132637 -1.402320 -0.703638
C 1.274541 -0.850934 -0.413126
C -2.362970 -0.121065 -0.485790
C -0.325277 -2.908363 -0.418949
C -3.061265 0.475710 0.584381
C -1.183359 -0.290866 1.399773
C 1.486078 0.554365 -0.426899
C 2.378051 -1.709481 -0.183062
C 2.767018 1.096022 -0.219987
C 3.669604 -1.185065 0.028738
C -4.378145 1.099238 0.373419
C 3.845130 0.212604 0.004494
C -4.134219 0.438626 -1.953155
H -0.320262 -1.232540 -1.785992
H -0.094315 -3.148516 0.633014
H 0.318323 -3.522198 -1.072360
H -1.373067 -3.195765 -0.610164
H -0.356790 -0.546329 2.058177
H 0.639110 1.229733 -0.588279
H 2.241726 -2.793983 -0.160890
H -2.381896 -0.593650 -2.562875
H 2.945593 2.174314 -0.225139
H 4.531452 -1.832336 0.210756
H -4.516424 0.394925 -2.980988


