%chk=000246951.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246951

0 1
O 1.776863 -1.424699 1.298706
O -0.403945 -3.746991 0.269976
O 1.371781 -3.217446 -0.989610
N -1.337945 -0.095669 -0.006284
C 0.112795 -0.409559 -0.275989
C -1.737100 1.228096 -0.598232
C -2.221068 -1.188652 -0.546030
C -3.196979 1.546679 -0.236203
C -3.688057 -0.906387 -0.182133
C -4.144891 0.449239 -0.731418
C 0.516727 -1.583328 0.675549
C 1.000755 0.788864 0.003185
C 1.012091 1.396538 1.268827
C 1.830834 1.282351 -1.013465
C 0.594920 -2.893063 -0.125574
C 1.845888 2.490292 1.511174
C 2.663747 2.377578 -0.765076
C 2.672449 2.982555 0.495174
H 0.272014 -0.733313 -1.341956
H -1.602082 1.256250 -1.700449
H -1.082835 2.019447 -0.169891
H -1.921784 -2.153163 -0.077139
H -2.121774 -1.312232 -1.645762
H -3.477356 2.526023 -0.664842
H -3.287844 1.648528 0.864333
H -3.800847 -0.918540 0.921121
H -4.327484 -1.719899 -0.570458
H -5.180704 0.663580 -0.409586
H -4.164666 0.428982 -1.837223
H -0.185246 -1.674371 1.546948
H 0.367841 1.003799 2.057966
H 1.832059 0.818741 -1.998754
H 2.476701 -1.170916 0.645300
H 1.854263 2.957880 2.494735
H 3.307318 2.758403 -1.556463
H 3.322614 3.834325 0.686764
H -0.369851 -4.628523 -0.191222


%chk=000246951-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246951

0 1
O 0.078733 -1.785734 1.745064
O 1.714606 -2.649562 -1.419249
O 2.570392 -2.346502 0.721974
N -1.530136 -0.034014 -0.065943
C -0.175451 -0.520957 -0.445543
C -1.955343 1.052783 -0.990519
C -2.575028 -1.080378 0.072077
C -3.263908 1.717532 -0.523076
C -3.909881 -0.470094 0.551672
C -4.384988 0.665740 -0.380026
C 0.193353 -1.860258 0.301380
C 0.879966 0.551950 -0.167288
C 0.878420 1.240062 1.073276
C 1.890796 0.840670 -1.116460
C 1.608297 -2.299880 -0.074841
C 1.880453 2.192972 1.360087
C 2.892133 1.797227 -0.831200
C 2.892629 2.472214 0.411006
H -0.133112 -0.790634 -1.533259
H -2.099068 0.652283 -2.030416
H -1.147069 1.803604 -1.039143
H -2.241290 -1.816177 0.822270
H -2.745919 -1.619216 -0.899053
H -3.551016 2.504763 -1.246540
H -3.086360 2.207460 0.453827
H -3.762843 -0.070095 1.573543
H -4.669294 -1.273381 0.613446
H -5.309913 1.128399 0.013309
H -4.629932 0.249108 -1.379360
H -0.505546 -2.648433 -0.028543
H 0.065293 1.034991 1.777245
H 1.885230 0.325673 -2.085481
H 0.966338 -1.532400 2.115789
H 1.872520 2.720763 2.320839
H 3.664932 2.019128 -1.576089
H 3.667856 3.214065 0.634134
H 2.653352 -2.912272 -1.622909


