%chk=000182804.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182804

0 1
O -5.644612 1.707072 -1.419766
N -6.086054 0.000779 0.015809
N 0.401488 0.416512 0.322539
N 3.037865 -2.855514 -0.363888
C 2.692868 -0.424181 0.039903
C 1.250867 -0.677355 0.070745
C 3.549582 -1.559719 -0.176688
C 4.666240 1.010834 0.156378
C 5.514759 -0.126365 -0.046447
C 3.273879 0.839935 0.194164
C 4.943976 -1.394236 -0.212125
C -1.000530 0.464520 0.075199
C -7.550987 0.129201 -0.223619
C -5.637934 -1.091326 0.914651
C -3.747146 0.695111 -0.377261
C -5.211513 0.859273 -0.652738
C 0.787631 -1.963473 -0.104144
C 5.273251 2.312597 0.315947
C 6.946833 0.071707 -0.078152
C -1.593959 -0.228847 -0.996456
C -1.783790 1.293211 0.909124
C -2.965643 -0.108236 -1.216368
C -3.152108 1.405417 0.673989
C 1.727905 -3.023491 -0.328691
C -8.238766 0.884618 0.912183
C -5.427947 -2.402650 0.156992
C 6.627353 2.457684 0.278654
C 7.479515 1.315454 0.078684
H 2.644667 1.719076 0.339772
H 5.573452 -2.272646 -0.373713
H 0.815667 1.245610 0.751669
H -7.705251 0.675404 -1.188198
H -7.990320 -0.883988 -0.345814
H -4.695040 -0.791422 1.426439
H -6.399084 -1.229754 1.716100
H -0.267792 -2.212762 -0.050012
H 4.617954 3.169575 0.464874
H 7.579364 -0.802289 -0.231396
H -0.985979 -0.832800 -1.670271
H -1.330074 1.840039 1.732427
H -3.428117 -0.631133 -2.056010
H -3.762302 2.050435 1.309098
H 1.348633 -4.044382 -0.475593
H -8.123816 0.380873 1.877317
H -7.827116 1.897374 1.020121
H -9.312062 0.989766 0.715957
H -6.336168 -2.722020 -0.367735
H -4.636493 -2.312129 -0.596847
H -5.140635 -3.209515 0.840773
H 7.096012 3.433481 0.397439
H 8.556878 1.476477 0.056183


%chk=000182804-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182804

0 1
O -5.606136 2.252753 0.012299
N -6.117191 -0.014064 -0.087476
N 0.505978 0.366087 0.552761
N 3.231723 -2.922799 0.039914
C 2.791356 -0.448308 0.154568
C 1.365918 -0.718984 0.330691
C 3.685138 -1.599305 0.038637
C 4.735870 1.068919 -0.061076
C 5.628797 -0.081016 -0.139898
C 3.339912 0.853017 0.080334
C 5.075630 -1.383761 -0.096116
C -0.901593 0.437417 0.425746
C -7.540425 0.358572 -0.304502
C -5.856146 -1.418582 0.307933
C -3.736915 0.744400 0.183926
C -5.207395 1.038308 0.036265
C 0.942976 -2.056871 0.317012
C 5.299941 2.391838 -0.137188
C 7.044989 0.146937 -0.278425
C -1.644482 -0.391415 -0.458714
C -1.592472 1.442381 1.161627
C -3.040341 -0.238652 -0.565117
C -2.980760 1.601770 1.026041
C 1.906924 -3.102830 0.164777
C -8.279681 0.703694 1.006978
C -5.988572 -2.433405 -0.848252
C 6.673357 2.574481 -0.272406
C 7.555370 1.439958 -0.341960
H 2.692300 1.739504 0.090465
H 5.714968 -2.269322 -0.174176
H 0.947337 1.210531 0.921240
H -7.555641 1.235854 -0.972199
H -8.036807 -0.482157 -0.822851
H -4.850303 -1.477890 0.753031
H -6.573845 -1.689791 1.109714
H -0.103316 -2.322981 0.479688
H 4.628786 3.257710 -0.084597
H 7.713751 -0.719738 -0.335243
H -1.131360 -1.117244 -1.094964
H -1.032042 2.098545 1.839437
H -3.582611 -0.865405 -1.280510
H -3.504182 2.398721 1.563445
H 1.560690 -4.144070 0.168592
H -8.264225 -0.140290 1.721224
H -7.810448 1.581328 1.481453
H -9.336958 0.946898 0.794743
H -7.003019 -2.423335 -1.284702
H -5.271942 -2.217876 -1.660129
H -5.793289 -3.456148 -0.476620
H 7.092374 3.585149 -0.326720
H 8.633413 1.603271 -0.447502


