%chk=000299872.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299872

0 1
O -3.580027 -0.843901 -0.997670
O -1.331448 2.553163 -0.404120
N -1.381808 -0.319191 -0.383389
N 0.358787 -1.766079 -0.217918
N 2.203896 -0.065108 0.029998
N 0.901508 2.637235 -0.068586
N 3.115666 -0.949565 -0.145177
N 4.355522 -0.642094 0.215020
C -2.771584 0.226061 -0.511224
C -3.342039 0.666375 0.847472
C -4.281982 -0.465528 1.286263
C -4.401826 -1.397174 0.074855
C -0.213304 0.466736 -0.249553
C -0.990469 -1.655400 -0.357471
C 0.855561 -0.461037 -0.150897
C -0.277278 1.933230 -0.253215
C 5.395321 -1.525706 -0.374331
C 4.805769 0.708721 0.639365
H -2.773845 1.013192 -1.308150
H -3.877692 1.628589 0.731452
H -2.548507 0.866330 1.590692
H -3.877067 -0.999669 2.164643
H -5.266012 -0.069956 1.593243
H -4.022512 -2.414008 0.259742
H -5.412963 -1.437591 -0.361947
H -1.679948 -2.483684 -0.459769
H 1.796471 2.185883 0.055275
H 0.883307 3.644096 -0.085327
H 4.955868 -2.490417 -0.697931
H 6.154204 -1.746992 0.395747
H 5.884547 -1.064106 -1.247681
H 5.807748 0.651707 1.090299
H 4.112790 1.107581 1.404758
H 4.829544 1.424008 -0.198966


%chk=000299872-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299872

0 1
O -3.633223 -0.786955 -1.072393
O -1.290378 2.738226 -0.152352
N -1.392709 -0.208125 -0.458642
N 0.344929 -1.683560 -0.449742
N 2.173173 0.003802 -0.071761
N 1.034651 2.569513 0.062670
N 3.043118 -0.988756 -0.075783
N 4.326870 -0.577851 0.090250
C -2.805963 0.292067 -0.539854
C -3.388282 0.632925 0.849834
C -3.941024 -0.730184 1.334644
C -4.482107 -1.346966 0.028747
C -0.230992 0.557415 -0.251201
C -0.992110 -1.532549 -0.574160
C 0.831685 -0.386654 -0.248383
C -0.223730 2.030104 -0.111873
C 5.335751 -1.641727 0.083891
C 4.701645 0.836127 0.247430
H -2.816978 1.144147 -1.233083
H -4.203863 1.365126 0.714379
H -2.635101 1.081378 1.512756
H -3.128368 -1.349308 1.754801
H -4.725714 -0.620165 2.101325
H -4.401730 -2.446771 -0.017489
H -5.527904 -1.046455 -0.170434
H -1.698171 -2.329847 -0.783670
H 1.846772 1.929080 0.077750
H 1.117267 3.580405 0.152488
H 4.807976 -2.598678 -0.042088
H 5.900700 -1.659347 1.034961
H 6.050596 -1.508527 -0.750279
H 5.795017 0.901286 0.359597
H 4.210854 1.272739 1.137911
H 4.383542 1.423785 -0.634747


