%chk=000278707.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278707

0 1
O -1.232819 -0.053703 2.689602
O -0.588980 0.283987 -1.854365
N -0.734601 0.170102 0.447534
C 2.966132 0.343678 0.032323
C 3.323428 1.171290 1.143034
C 4.819808 1.379103 1.180361
C 4.194894 -0.011912 -0.691185
C 5.301759 0.594649 -0.019050
C 0.665699 0.510991 0.675269
C 1.645524 0.003114 -0.207306
C 2.352118 1.658548 2.000056
C 1.007145 1.329137 1.760005
C 4.394158 -0.780683 -1.828229
C 6.592930 0.423569 -0.487889
C -3.559547 -1.182587 0.287002
C -3.769615 0.139971 -0.336170
C -1.494247 -0.364959 1.551645
C -1.283350 0.384250 -0.871114
C -2.503075 -1.405549 1.183036
C -2.701481 0.858362 -0.894489
C 5.708555 -0.950443 -2.299610
C 6.787137 -0.359910 -1.641298
C -4.438587 -2.239203 -0.012185
C -5.063823 0.688767 -0.384783
C -2.348250 -2.659950 1.796421
C -2.930695 2.093635 -1.522914
C -4.270237 -3.488802 0.584904
C -5.284436 1.924774 -0.993101
C -3.228387 -3.699465 1.496075
C -4.218962 2.626284 -1.569949
H 5.088471 2.449925 1.105788
H 5.263303 1.004241 2.122328
H 1.363241 -0.618118 -1.058852
H 2.611437 2.287220 2.848923
H 0.232272 1.696928 2.437214
H 3.556165 -1.240670 -2.347416
H 7.441270 0.879219 0.014810
H 5.880628 -1.550915 -3.191110
H 7.797427 -0.503089 -2.021569
H -5.248959 -2.082906 -0.724881
H -5.897045 0.149521 0.066896
H -1.536549 -2.815363 2.511967
H -2.095167 2.632833 -1.976849
H -4.952962 -4.303778 0.341855
H -6.290315 2.345301 -1.020370
H -3.104153 -4.673049 1.969581
H -4.394561 3.586552 -2.054246


%chk=000278707-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000278707

0 1
O -0.774044 -0.645769 2.572847
O -0.596005 1.152576 -1.726468
N -0.709748 0.248169 0.419855
C 3.035296 0.362083 0.051754
C 3.376702 1.316547 1.058086
C 4.886728 1.521751 1.088660
C 4.273593 -0.087091 -0.612199
C 5.380509 0.586798 -0.010645
C 0.698348 0.606647 0.628374
C 1.690824 -0.003323 -0.166634
C 2.375216 1.912796 1.843104
C 1.023269 1.557438 1.623388
C 4.478312 -1.006940 -1.664232
C 6.691308 0.341665 -0.455233
C -3.554872 -1.198062 0.241860
C -3.824827 0.161040 -0.294741
C -1.310453 -0.570864 1.433369
C -1.322105 0.755416 -0.774192
C -2.425338 -1.506235 1.055037
C -2.801413 1.024911 -0.782749
C 5.798522 -1.250341 -2.108796
C 6.896925 -0.583325 -1.510195
C -4.494752 -2.236671 -0.017799
C -5.174581 0.609044 -0.378556
C -2.296421 -2.804331 1.623239
C -3.150996 2.267834 -1.380363
C -4.340519 -3.528384 0.517518
C -5.509176 1.855934 -0.937323
C -3.237467 -3.814390 1.355844
C -4.490230 2.690475 -1.453687
H 5.163829 2.575792 0.889661
H 5.317119 1.263312 2.076288
H 1.407583 -0.724438 -0.938579
H 2.627170 2.642930 2.619966
H 0.224992 1.995795 2.228587
H 3.633172 -1.522780 -2.133826
H 7.545613 0.854860 0.001501
H 5.975892 -1.960034 -2.924647
H 7.913028 -0.784285 -1.868017
H -5.344561 -2.028282 -0.675675
H -5.967994 -0.024885 0.030197
H -1.442734 -2.993431 2.280700
H -2.345325 2.885563 -1.787861
H -5.074118 -4.306965 0.282530
H -6.556235 2.175625 -0.969594
H -3.110826 -4.811478 1.789884
H -4.736512 3.658200 -1.902542


