%chk=000274258.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274258

0 1
O 2.467019 1.948874 -1.164095
O -1.414435 -3.439705 -0.300461
O -5.161346 0.368736 -0.610800
O -4.772178 0.338236 1.522012
N 3.838687 -0.067861 0.422983
N -2.323012 2.027196 0.025934
N -4.453315 0.197315 0.359377
C 2.455198 0.407434 0.731615
C 1.798361 0.797349 -0.616607
C 0.356637 1.211185 -0.410501
C 3.889362 -1.563900 0.307162
C 4.844874 0.450144 1.408395
C -0.672396 0.212571 -0.281551
C -1.999708 0.679314 -0.052627
C 0.018895 2.541626 -0.337004
C -0.427680 -1.189326 -0.375857
C 5.117912 -1.979084 -0.502698
C 5.134706 1.925006 1.129482
C -3.055184 -0.286399 0.099346
C -1.346687 2.915517 -0.119913
C -1.477462 -2.070383 -0.234894
C -2.823152 -1.630075 0.014781
C -0.131073 -4.046345 -0.595317
H 1.830718 -0.333746 1.270463
H 2.482395 1.310669 1.382603
H 1.885304 -0.018051 -1.372650
H 3.893988 -2.070065 1.297162
H 2.973824 -1.908261 -0.221955
H 4.521034 0.314181 2.462902
H 5.785422 -0.134818 1.288705
H 0.784222 3.315548 -0.455499
H 0.582352 -1.537764 -0.571417
H 5.159514 -1.441654 -1.460237
H 6.053084 -1.755024 0.024608
H 5.105341 -3.052188 -0.718682
H 5.531835 2.067340 0.116240
H 4.235234 2.548008 1.212544
H 5.875949 2.318450 1.833944
H 3.444249 1.786319 -1.148503
H -1.624353 3.977249 -0.064426
H -3.606208 -2.385137 0.122879
H -0.390940 -5.114536 -0.605448
H 0.585186 -3.825485 0.200532
H 0.226629 -3.722658 -1.577225


%chk=000274258-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000274258

0 1
O 2.688012 1.401121 -1.390664
O -1.837111 -3.470657 -0.034177
O -5.464259 0.098198 -0.087798
O -4.470039 1.421965 1.486649
N 3.945718 -0.060035 0.392213
N -2.170283 2.149707 -0.150406
N -4.432556 0.540090 0.555086
C 2.471269 -0.009537 0.580305
C 1.814361 0.405764 -0.790894
C 0.417927 0.973850 -0.594648
C 4.416189 -1.375349 -0.139865
C 4.720537 0.422251 1.576328
C -0.718151 0.125096 -0.319189
C -1.987784 0.783532 -0.073163
C 0.214378 2.356054 -0.660188
C -0.641018 -1.306840 -0.298293
C 5.740009 -1.273389 -0.919265
C 4.677236 1.952557 1.737854
C -3.117727 -0.060903 0.217008
C -1.088921 2.896652 -0.446618
C -1.787516 -2.074260 -0.056187
C -3.044709 -1.445829 0.200657
C -0.595795 -4.199736 -0.309566
H 2.050954 -0.968229 0.953432
H 2.237458 0.772748 1.322010
H 1.761958 -0.488222 -1.453910
H 4.510139 -2.121769 0.684432
H 3.632808 -1.752193 -0.824395
H 4.361696 -0.072709 2.509238
H 5.769975 0.108566 1.435073
H 1.061362 3.001804 -0.903494
H 0.315532 -1.795866 -0.498459
H 5.635993 -0.568109 -1.762190
H 6.573206 -0.926840 -0.282321
H 6.021556 -2.262811 -1.323777
H 5.093522 2.449523 0.844264
H 3.648863 2.327592 1.885473
H 5.272670 2.257426 2.617732
H 3.589263 1.161187 -0.980108
H -1.257620 3.976861 -0.522545
H -3.927524 -2.063571 0.384053
H -0.868724 -5.262743 -0.249018
H 0.179322 -3.969023 0.447143
H -0.213376 -3.968122 -1.322509


