%chk=000239576.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239576

0 1
O 3.346085 -2.120363 -0.664665
O 3.616216 2.146778 1.093262
O -3.629921 2.156256 -1.026589
O -3.333181 -2.162269 0.596391
N 3.116640 -0.031257 0.382026
N -3.116720 -0.039857 -0.383937
C 0.716660 -0.075434 -0.271368
C -0.716451 -0.088392 0.268029
C 1.727331 -0.142480 0.884177
C -1.726779 -0.126647 -0.889133
C 3.797493 -1.046542 -0.375361
C 3.937261 1.142742 0.519163
C -3.944666 1.132698 -0.484356
C -3.791269 -1.082699 0.340970
C 5.155503 -0.443824 -0.692989
C 5.233364 0.792511 -0.189641
C -5.238565 0.752302 0.212846
C -5.152997 -0.498726 0.677122
H 0.889556 0.836659 -0.876648
H 0.880292 -0.934077 -0.956313
H -0.874385 -0.968650 0.926350
H -0.895268 0.803595 0.900927
H 1.626807 -1.106806 1.434246
H 1.554675 0.684565 1.612914
H -1.559569 0.723399 -1.592213
H -1.620058 -1.073035 -1.468410
H 5.883258 -1.014385 -1.249858
H 6.041749 1.507162 -0.223528
H -6.051381 1.460492 0.269020
H -5.877177 -1.091016 1.215667


%chk=000239576-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239576

0 1
O 3.595415 -2.355608 0.340466
O 3.427927 2.331603 0.098067
O -3.585022 2.366213 -0.206079
O -3.438857 -2.327729 -0.235204
N 3.147336 -0.017479 0.355497
N -3.147687 0.031041 -0.355769
C 0.718879 0.027617 -0.279476
C -0.719311 -0.006931 0.280545
C 1.764697 -0.039887 0.856131
C -1.764888 0.075187 -0.854314
C 3.947404 -1.169090 0.128131
C 3.864338 1.157246 0.007514
C -3.942516 1.171078 -0.062257
C -3.869917 -1.158703 -0.076318
C 5.268852 -0.663228 -0.398920
C 5.220278 0.695011 -0.469639
C -5.266177 0.641526 0.435202
C -5.224015 -0.718761 0.426564
H 0.875573 0.957285 -0.859884
H 0.875600 -0.826359 -0.966962
H -0.878365 -0.941709 0.852141
H -0.873638 0.840789 0.976299
H 1.642288 -0.974218 1.433280
H 1.637775 0.819933 1.539073
H -1.647230 1.021042 -1.413347
H -1.632931 -0.770726 -1.553409
H 6.082542 -1.341040 -0.657179
H 5.984860 1.398340 -0.799783
H -6.076852 1.306864 0.732449
H -5.991851 -1.436607 0.715282


