%chk=000269646.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269646

0 1
O 5.414040 -1.385226 0.154584
N -1.944894 -0.217325 -0.586057
N 2.895373 -0.085568 -0.056023
N -0.850517 1.888317 -0.388675
C -3.284147 0.439066 -0.570384
C -4.277321 -0.451758 -1.346674
C -3.773702 0.710856 0.868371
C -4.680297 -1.717962 -0.580870
C -4.161358 -0.568420 1.616826
C -5.191909 -1.386765 0.827402
C -0.771498 0.505488 -0.370199
C 2.972318 -1.534794 0.287483
C 4.095335 0.661877 0.419904
C 1.644668 0.558235 -0.096206
C 0.453126 -0.185904 -0.201742
C 4.263099 -2.115436 -0.314700
C 5.351377 0.014155 -0.186715
C 1.565450 1.975515 -0.125992
C 0.313750 2.573219 -0.277708
H -3.184263 1.425123 -1.105510
H -3.846830 -0.724711 -2.329880
H -5.180070 0.150716 -1.568324
H -4.641358 1.396677 0.822158
H -2.989539 1.260778 1.426051
H -3.821667 -2.412456 -0.515731
H -5.462008 -2.260014 -1.146720
H -4.569561 -0.308600 2.612038
H -3.260630 -1.180477 1.811484
H -6.141079 -0.821185 0.756079
H -5.432005 -2.319005 1.371181
H -1.940053 -1.201065 -0.328572
H 2.087289 -2.069894 -0.127063
H 2.963134 -1.684021 1.390547
H 4.156725 0.649765 1.531382
H 4.028423 1.728530 0.103978
H 0.468614 -1.268199 -0.190469
H 4.466633 -3.138701 0.047459
H 4.246984 -2.094207 -1.418941
H 5.378538 0.119858 -1.285831
H 6.280195 0.410034 0.260896
H 2.454623 2.588922 -0.049673
H 0.215613 3.666461 -0.305063


%chk=000269646-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000269646

0 1
O 5.485774 -1.443514 0.228814
N -1.968602 -0.246449 -0.506251
N 2.925372 -0.107879 -0.080087
N -0.891808 1.843047 -0.396689
C -3.300236 0.382094 -0.638567
C -4.281056 -0.618777 -1.299072
C -3.856750 0.865909 0.730800
C -4.652796 -1.799063 -0.364273
C -4.213101 -0.311709 1.666717
C -5.204834 -1.289866 0.989720
C -0.788368 0.472433 -0.385434
C 3.017305 -1.582594 -0.109210
C 4.040782 0.524518 0.665218
C 1.665676 0.524942 -0.149813
C 0.458582 -0.213244 -0.255260
C 4.412325 -2.029050 -0.586395
C 5.398078 0.023214 0.146694
C 1.552964 1.956523 -0.159084
C 0.280171 2.533561 -0.284337
H -3.168644 1.267991 -1.286646
H -3.854787 -0.990380 -2.251471
H -5.207564 -0.067005 -1.553051
H -4.765901 1.473105 0.538210
H -3.111773 1.536153 1.195073
H -3.765689 -2.442129 -0.177072
H -5.397801 -2.447555 -0.864682
H -4.641701 0.073478 2.612103
H -3.285599 -0.856474 1.938732
H -6.166191 -0.764420 0.810425
H -5.425346 -2.144064 1.659175
H -1.914208 -1.263915 -0.485829
H 2.274235 -1.983176 -0.820657
H 2.807132 -2.018110 0.894608
H 3.956577 0.287345 1.749929
H 3.998643 1.619161 0.557122
H 0.452750 -1.306550 -0.217606
H 4.524240 -3.121359 -0.487542
H 4.550629 -1.735151 -1.649869
H 5.543831 0.348281 -0.906424
H 6.221494 0.405545 0.771813
H 2.425432 2.610915 -0.104620
H 0.181362 3.626115 -0.301110


