%chk=000281667.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281667

0 1
O -3.069047 1.003400 -1.190249
O 4.060415 -0.782702 -1.238818
O -4.495042 -0.743538 -1.415311
O 4.465122 1.403922 -1.678505
N -1.503709 -0.212121 0.626166
N 2.140437 -0.301194 0.575738
C 0.336596 -0.652712 2.297196
C -0.905750 -1.031758 1.566990
C 1.241121 0.214491 1.494848
C -1.688916 -2.203318 1.704076
C 1.356095 1.624434 1.488949
C -2.792975 -2.086641 0.815576
C 2.361827 1.970463 0.543387
C -2.661538 -0.847704 0.146033
C 2.835214 0.764025 -0.021083
C -3.894979 -3.063299 0.608938
C 2.842229 3.333136 0.193389
C -1.397183 -3.329402 2.616695
C 0.575292 2.556289 2.329826
C -3.520796 -0.270984 -0.873613
C 3.849551 0.575961 -1.046166
C -4.876180 -3.059361 1.781576
C 3.686114 3.938225 1.315415
C -3.774532 1.732838 -2.241335
C 5.014439 -1.182718 -2.271504
C -3.327325 1.233139 -3.599548
C 4.364493 -1.081846 -3.635641
H 0.865073 -1.574950 2.634971
H 0.059862 -0.126278 3.244351
H -1.171085 0.682531 0.299366
H 2.281516 -1.267887 0.334183
H -4.444277 -2.823286 -0.333358
H -3.476744 -4.080791 0.462304
H 3.446782 3.295125 -0.744887
H 1.977861 3.992079 -0.032651
H -0.366418 -3.691576 2.502637
H -2.061541 -4.186217 2.429741
H -1.536618 -3.038122 3.667969
H 1.038239 2.676815 3.321302
H -0.455762 2.211946 2.487067
H 0.518334 3.558459 1.879260
H -5.354995 -2.077914 1.890663
H -5.670863 -3.798165 1.631855
H -4.376099 -3.286322 2.729634
H 4.026775 4.945425 1.051448
H 4.578089 3.329543 1.510556
H 3.124131 4.006320 2.253511
H -3.453605 2.768542 -2.028909
H -4.861741 1.615245 -2.082486
H 5.230572 -2.222005 -1.964983
H 5.915225 -0.548848 -2.182038
H -2.233445 1.224442 -3.686441
H -3.673933 0.203281 -3.775276
H -3.724429 1.856880 -4.408371
H 3.397976 -1.600634 -3.663106
H 4.175658 -0.031854 -3.907229
H 5.000389 -1.513910 -4.416912


%chk=000281667-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000281667

0 1
O -2.607971 0.429163 -1.777777
O 2.820076 -0.406380 -1.573737
O -3.948292 -1.502578 -1.907354
O 4.069385 1.589944 -1.578528
N -1.551069 -0.247576 0.582364
N 1.549119 0.193934 0.707245
C -0.074600 -0.068020 2.632139
C -1.083467 -0.791060 1.768502
C 0.967290 0.705540 1.857398
C -1.739513 -2.031532 1.964374
C 1.548142 1.973567 2.108237
C -2.625245 -2.237078 0.847739
C 2.506005 2.228702 1.063690
C -2.487640 -1.110771 -0.001341
C 2.486374 1.104259 0.201662
C -3.546300 -3.413352 0.631122
C 3.385384 3.447318 0.921165
C -1.554815 -2.963897 3.136243
C 1.230110 2.890399 3.263913
C -3.101705 -0.808275 -1.283759
C 3.211975 0.846357 -1.030924
C -4.930171 -3.221908 1.311850
C 4.785703 3.253472 1.566551
C -3.091162 0.839884 -3.125433
C 3.423070 -0.773551 -2.885172
C -2.191306 0.259613 -4.221562
C 2.586489 -0.213086 -4.040182
H 0.409197 -0.814527 3.293906
H -0.587515 0.638202 3.315243
H -1.252811 0.627339 0.149764
H 1.326853 -0.690846 0.250083
H -3.706571 -3.559761 -0.451282
H -3.073471 -4.332798 1.028414
H 3.527737 3.675979 -0.150026
H 2.887770 4.319139 1.388035
H -0.585573 -2.802602 3.641774
H -1.589780 -4.020912 2.815180
H -2.347156 -2.832908 3.898799
H 2.015473 2.858220 4.043674
H 0.274951 2.622681 3.749913
H 1.149057 3.941897 2.932217
H -5.448201 -2.344087 0.887332
H -5.569404 -4.108848 1.148595
H -4.825683 -3.067087 2.401472
H 5.390755 4.172965 1.464783
H 5.325836 2.431753 1.064711
H 4.703828 3.009955 2.641724
H -3.052544 1.941194 -3.098969
H -4.134515 0.498262 -3.243901
H 3.429706 -1.875771 -2.876495
H 4.456979 -0.386906 -2.917343
H -1.138101 0.551320 -4.061945
H -2.259894 -0.841244 -4.237575
H -2.509915 0.639809 -5.210176
H 1.537439 -0.550583 -3.966687
H 2.609387 0.889773 -4.036580
H 2.996202 -0.563796 -5.005868


