%chk=000230542.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230542

0 1
O -0.916967 2.619171 -0.488943
O -1.396533 1.574900 1.460196
N 0.803909 0.047958 -0.182835
N 3.581034 -0.628837 -0.687221
C 1.696058 0.947591 -0.992955
C 1.229965 -1.377804 -0.364769
C 3.146491 0.795017 -0.498173
C 2.688682 -1.532262 0.111944
C -0.634020 0.292756 -0.548535
C -1.548604 -0.879601 -0.266003
C 5.004229 -0.799728 -0.268405
C -1.030775 1.502379 0.315865
C -1.856875 -1.262980 1.047654
C -2.089716 -1.594412 -1.345442
C -2.701107 -2.351753 1.277846
C -2.932871 -2.683676 -1.109062
C -3.239403 -3.064147 0.201301
C -1.191792 3.928396 0.099451
C -0.009078 4.374895 0.933912
H 1.360379 1.999790 -0.848546
H 1.648272 0.730890 -2.082804
H 1.136379 -1.721885 -1.417544
H 0.579598 -2.029421 0.259405
H 3.810480 1.445854 -1.105678
H 3.221189 1.136102 0.557539
H 2.744711 -1.339396 1.205862
H 3.015117 -2.580557 -0.057319
H -0.749947 0.594100 -1.629914
H 5.310401 -1.840800 -0.460235
H 5.211278 -0.566733 0.786372
H 5.641712 -0.157804 -0.897415
H -1.441728 -0.695464 1.887754
H -1.857559 -1.305758 -2.369104
H -2.941599 -2.642564 2.299490
H -3.352575 -3.235562 -1.948355
H -3.897734 -3.911647 0.382925
H -1.343785 4.540598 -0.807590
H -2.123810 3.858619 0.688468
H -0.144263 5.395804 1.308899
H 0.127108 3.717638 1.807222
H 0.925651 4.346632 0.361041


%chk=000230542-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230542

0 1
O -1.409875 2.436698 -0.560540
O -0.444983 1.838514 1.479166
N 1.079960 -0.135477 -0.121484
N 3.879243 -0.812012 -0.505728
C 2.118555 0.920456 -0.265395
C 1.486312 -1.350728 -0.878326
C 3.474006 0.402963 0.239605
C 2.843173 -1.862734 -0.372910
C -0.275603 0.325943 -0.509319
C -1.350651 -0.729828 -0.210875
C 5.219495 -1.290320 -0.119325
C -0.673989 1.592754 0.275303
C -1.373191 -1.377065 1.050366
C -2.346853 -1.031814 -1.168338
C -2.378536 -2.324055 1.341733
C -3.355134 -1.978933 -0.875406
C -3.372941 -2.627847 0.380645
C -1.984251 3.666586 0.071928
C -0.978142 4.819685 0.024767
H 1.826169 1.796815 0.337818
H 2.228636 1.238360 -1.332641
H 1.567134 -1.135096 -1.973574
H 0.722496 -2.134514 -0.737089
H 4.242327 1.184759 0.088999
H 3.392341 0.203973 1.338786
H 2.727669 -2.194145 0.691398
H 3.148417 -2.740637 -0.973145
H -0.337126 0.596074 -1.592152
H 5.499147 -2.158138 -0.743730
H 5.287533 -1.601184 0.954804
H 5.963475 -0.491541 -0.291094
H -0.596773 -1.128640 1.781831
H -2.334725 -0.524732 -2.140733
H -2.391499 -2.822090 2.317962
H -4.121271 -2.210267 -1.624049
H -4.153727 -3.362232 0.609264
H -2.881264 3.873056 -0.533452
H -2.270344 3.423939 1.110489
H -1.451035 5.742198 0.410137
H -0.097639 4.597733 0.650684
H -0.644633 5.009819 -1.010081


