%chk=000291262.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291262

0 1
O -2.905119 -1.221623 1.004410
O -3.405473 1.837409 -0.659665
O -1.673597 3.245958 -0.257032
O 4.844482 2.229481 0.166550
O 5.110713 0.129138 -0.278281
N -1.133243 0.201195 0.805071
N 4.422182 1.094786 0.016405
C 0.237609 0.438372 0.584470
C 1.085889 -0.655729 0.233859
C 0.530979 -1.998505 0.060787
C -0.842051 -2.207468 0.293075
C -1.730695 -1.114787 0.714237
C -2.044092 1.305305 1.189364
C 2.456665 -0.415336 0.053699
C 0.788677 1.741411 0.712749
C 1.324332 -3.097233 -0.335270
C -1.409458 -3.489924 0.132963
C 2.981572 0.869333 0.204190
C 2.139814 1.957042 0.527771
C 0.757389 -4.356669 -0.491638
C -0.614401 -4.558455 -0.257986
C -2.302159 2.251267 0.019229
C -3.825078 2.604250 -1.840956
C -2.909567 2.297218 -3.004660
H -3.024782 0.864443 1.536182
H -1.630127 1.884838 2.047953
H 3.132784 -1.242939 -0.209258
H 0.145094 2.602198 0.929514
H 2.390917 -2.958310 -0.521446
H -2.479936 -3.622415 0.322720
H 2.571681 2.961441 0.625373
H 1.380357 -5.199231 -0.798727
H -1.046795 -5.550412 -0.383708
H -4.852019 2.215033 -1.973701
H -3.837098 3.675405 -1.573600
H -3.290357 2.728678 -3.938822
H -1.901035 2.707000 -2.841904
H -2.799757 1.215432 -3.159417


%chk=000291262-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291262

0 1
O -3.013486 -1.434628 1.355554
O -2.707671 1.466900 -0.936261
O -2.894397 3.312916 0.485382
O 4.449670 2.501601 -0.588748
O 4.815509 0.289736 -1.021379
N -1.269378 0.070416 0.966084
N 4.062545 1.268626 -0.634858
C 0.046263 0.360546 0.564371
C 0.914867 -0.699122 0.123278
C 0.409544 -2.080738 0.088958
C -0.931731 -2.333844 0.506338
C -1.821110 -1.245920 0.965513
C -2.176397 1.149266 1.395661
C 2.233285 -0.368617 -0.265867
C 0.527015 1.704029 0.597306
C 1.198234 -3.186107 -0.340790
C -1.460523 -3.651326 0.492518
C 2.679414 0.961879 -0.221488
C 1.835076 2.011281 0.209546
C 0.669075 -4.487516 -0.352030
C -0.666905 -4.727226 0.066086
C -2.612153 2.109375 0.285196
C -3.169805 2.293652 -2.101804
C -1.987888 3.013490 -2.754671
H -3.083293 0.641872 1.777736
H -1.739506 1.744319 2.213992
H 2.935920 -1.131110 -0.608104
H -0.121157 2.517918 0.928791
H 2.230565 -3.035685 -0.669242
H -2.494477 -3.791423 0.822458
H 2.214573 3.035598 0.232921
H 1.294519 -5.322210 -0.686265
H -1.072755 -5.743793 0.055162
H -3.627384 1.549132 -2.771578
H -3.931893 3.006155 -1.740716
H -2.332852 3.535390 -3.666321
H -1.556517 3.765590 -2.073027
H -1.200499 2.297176 -3.045199


