%chk=000281642.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281642

0 1
O 3.900069 2.308260 -0.171111
O 0.394261 -0.296065 2.545870
O -1.786234 -0.563036 2.157786
O 1.783384 -3.563061 -0.495676
O -0.074223 -2.577236 -0.017141
N 1.125712 -2.562828 -0.240865
C 1.187174 -0.053107 0.054188
C -0.272850 0.027643 0.319801
C 1.839525 -1.283142 -0.216615
C 1.925700 1.126514 0.048681
C 3.313653 1.078058 -0.203814
C -1.112562 0.412457 -0.660193
C 3.228131 -1.307359 -0.465176
C -2.572592 0.557391 -0.589862
C 3.974106 -0.137225 -0.464700
C -3.388074 -0.469470 -0.091092
C -3.158321 1.739167 -1.082004
C -0.699000 -0.310650 1.697742
C -4.778060 -0.313466 -0.082238
C -4.544660 1.891565 -1.058744
C -5.356540 0.864149 -0.561520
C 5.332009 2.397688 -0.397954
H 1.455980 2.087403 0.263122
H -0.692551 0.664779 -1.647656
H 3.713891 -2.273278 -0.663006
H 5.042298 -0.172869 -0.657275
H -2.935779 -1.385389 0.301361
H -2.531318 2.539174 -1.471246
H -5.406598 -1.112978 0.308692
H -4.996873 2.809957 -1.428869
H -6.438631 0.985397 -0.547751
H 5.578814 2.049708 -1.404986
H 5.873671 1.845704 0.375764
H 5.502015 3.479343 -0.301367
H 0.145371 -0.535097 3.479454


%chk=000281642-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000281642

0 1
O 3.581571 2.493432 -0.277823
O 0.499103 -1.360280 2.492512
O -1.780593 -1.424001 2.140690
O 2.358391 -3.747998 -0.284402
O 0.241987 -2.976846 0.029239
N 1.514858 -2.780168 -0.110925
C 1.177961 -0.275405 0.148513
C -0.287107 -0.351105 0.481714
C 2.029385 -1.400912 -0.093891
C 1.771642 1.001022 0.065327
C 3.147087 1.171837 -0.233997
C -1.150048 0.346750 -0.346234
C 3.403046 -1.237724 -0.379917
C -2.593004 0.623637 -0.411943
C 3.976996 0.041262 -0.451063
C -3.614340 0.073177 0.421735
C -2.990699 1.535769 -1.443029
C -0.647150 -1.086417 1.721391
C -4.962926 0.435966 0.228492
C -4.337648 1.897243 -1.628354
C -5.334696 1.346649 -0.788305
C 5.003369 2.745129 -0.554464
H 1.174275 1.893837 0.270089
H -0.618362 0.824568 -1.184393
H 4.002118 -2.134774 -0.556025
H 5.041782 0.145052 -0.674512
H -3.339378 -0.640337 1.200460
H -2.223536 1.963150 -2.101547
H -5.731727 -0.001002 0.875434
H -4.611740 2.599025 -2.423512
H -6.386677 1.619410 -0.929016
H 5.289026 2.358885 -1.550955
H 5.645263 2.293158 0.224811
H 5.106207 3.839132 -0.534696
H 0.216466 -1.883018 3.290194


