%chk=000236308.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236308

0 1
O -2.314643 -2.335124 0.127914
O -4.358224 -1.163098 0.417222
N 1.561950 1.038710 1.007359
C 1.097048 2.215946 0.222230
C 0.223360 1.811014 -0.997063
C -1.023396 1.063411 -0.621626
C 0.351943 3.160911 1.168402
C -0.947195 -0.346369 -0.448136
C -2.229146 1.747659 -0.450692
C -2.116722 -0.980810 -0.103269
C -3.344668 -0.274701 0.071565
C 2.477940 0.125502 0.423528
C -3.429336 1.087716 -0.097290
C -3.736327 -2.488210 0.454547
C 2.497469 -1.208211 0.896938
C 3.419912 0.535819 -0.544010
C 3.455324 -2.096954 0.414984
C 4.367283 -0.373981 -1.013121
C 4.391447 -1.690233 -0.542960
H 2.008985 2.743309 -0.173637
H 0.837989 1.197170 -1.691049
H -0.030106 2.724130 -1.572554
H 0.808404 0.598907 1.543603
H 0.973535 3.418679 2.036918
H -0.576150 2.720327 1.553691
H 0.084654 4.095267 0.663936
H -0.014949 -0.889315 -0.590433
H -2.261870 2.827278 -0.592491
H -4.360601 1.631550 0.030176
H -3.805487 -2.865393 1.483063
H -4.197392 -3.100877 -0.331191
H 1.778803 -1.537258 1.642080
H 3.424791 1.559207 -0.907765
H 3.472267 -3.121800 0.785875
H 5.097082 -0.051822 -1.755748
H 5.131528 -2.391555 -0.915695


%chk=000236308-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000236308

0 1
O -2.482346 -2.307987 0.138548
O -4.551928 -1.097469 0.326215
N 1.585831 0.940154 0.923344
C 1.091829 2.157416 0.264889
C 0.185644 1.852234 -0.988096
C -1.101318 1.114052 -0.661963
C 0.372118 3.036590 1.306008
C -1.071018 -0.299272 -0.444321
C -2.331272 1.813617 -0.549003
C -2.273885 -0.927336 -0.117049
C -3.488128 -0.218568 -0.005883
C 2.575958 0.091119 0.414424
C -3.551371 1.159688 -0.219416
C -3.939686 -2.451523 0.398904
C 2.826478 -1.157270 1.063318
C 3.369106 0.431104 -0.722761
C 3.835126 -2.021779 0.598256
C 4.379191 -0.445336 -1.174555
C 4.625062 -1.676671 -0.525911
H 1.969947 2.721013 -0.110623
H 0.790682 1.260051 -1.700970
H -0.042135 2.817803 -1.479219
H 1.004232 0.570144 1.676813
H 1.054972 3.288292 2.136376
H -0.512969 2.518768 1.720426
H 0.021317 3.976844 0.845068
H -0.143260 -0.868622 -0.548722
H -2.345500 2.894670 -0.727909
H -4.494902 1.705716 -0.142027
H -4.084618 -2.856983 1.415003
H -4.383800 -3.089161 -0.385558
H 2.225193 -1.438117 1.938041
H 3.210015 1.377933 -1.248602
H 4.005290 -2.972800 1.116497
H 4.977721 -0.159814 -2.047905
H 5.407925 -2.351700 -0.886336


