%chk=000246501.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246501

0 1
O -1.360079 2.785678 0.704478
O -3.441715 -0.951607 0.290680
O -1.736487 1.887986 -1.345385
O -2.510243 -2.797779 -0.628207
N 1.560153 2.792419 -0.868299
N 3.538980 0.454064 1.957173
N 1.224109 -0.061027 -3.097799
N 3.465609 -2.298572 -0.347225
C 0.156336 0.464233 1.359855
C 0.091167 -1.616368 -0.187292
C -1.171191 0.447224 0.557170
C -1.182255 -0.755424 -0.417299
C 1.417005 0.504614 0.407402
C 1.354535 -0.752388 -0.569573
C 0.223266 -0.862136 2.092845
C 0.191209 -1.935074 1.291034
C -1.451174 1.743512 -0.183197
C -2.404617 -1.647604 -0.279591
C 1.484590 1.777062 -0.326787
C 2.616975 0.462986 1.265164
C 1.278332 -0.346700 -1.982162
C 2.548240 -1.606080 -0.436020
C -1.560861 4.123630 0.161130
C -4.707757 -1.659692 0.421415
H 0.176531 1.345577 2.043056
H 0.051348 -2.538073 -0.817244
H -2.009598 0.332809 1.309501
H -1.208055 -0.374811 -1.483241
H 0.288814 -0.866083 3.172457
H 0.223709 -2.972254 1.600789
H -1.609668 4.740114 1.064730
H -2.490825 4.159827 -0.415494
H -0.699988 4.380814 -0.468004
H -5.072150 -1.940027 -0.572583
H -5.348404 -0.907894 0.895342
H -4.570941 -2.544558 1.050682


%chk=000246501-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246501

0 1
O -1.350196 2.837136 0.781529
O -3.536332 -0.918452 0.183352
O -1.825452 1.878813 -1.289035
O -2.454514 -2.879919 -0.445226
N 1.503390 2.839666 -0.934071
N 3.654045 0.499803 1.919121
N 1.115742 -0.107198 -3.164241
N 3.499654 -2.370275 -0.382986
C 0.210822 0.456813 1.407358
C 0.089209 -1.637157 -0.138466
C -1.148985 0.454272 0.626908
C -1.186462 -0.762828 -0.339983
C 1.455780 0.524508 0.399383
C 1.360941 -0.782919 -0.590636
C 0.321207 -0.869505 2.144677
C 0.256671 -1.961809 1.337902
C -1.471401 1.768651 -0.096488
C -2.423378 -1.652583 -0.202076
C 1.472609 1.794433 -0.363115
C 2.691608 0.493998 1.216821
C 1.234457 -0.382290 -2.010937
C 2.563207 -1.638801 -0.467834
C -1.567425 4.185209 0.188149
C -4.819751 -1.667717 0.242211
H 0.259765 1.332448 2.072130
H 0.027860 -2.539884 -0.765389
H -1.931525 0.349405 1.399632
H -1.219939 -0.374703 -1.380866
H 0.451346 -0.903611 3.229501
H 0.322123 -2.996702 1.681912
H -1.506174 4.878091 1.038120
H -2.554877 4.228525 -0.299321
H -0.774383 4.384617 -0.551616
H -5.051870 -2.089621 -0.749210
H -5.565314 -0.918993 0.541623
H -4.747559 -2.483027 0.980671


