%chk=000208858.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208858

0 1
O 3.202049 -1.923096 -0.862757
O 0.617571 -0.595953 -0.519395
O 1.301606 5.718046 0.062817
O 2.725648 4.879849 -1.440670
O -0.511573 1.264495 -0.493541
N -3.354019 1.121355 0.580508
N -4.327704 -0.746650 -0.283955
N -4.707356 1.222232 0.506617
N -5.275642 0.088268 -0.013253
C 2.710945 1.172537 0.987546
C 3.629441 0.028026 0.547327
C 2.992476 2.475625 0.229138
C 3.319758 -0.466403 -0.864088
C 1.801053 3.434273 0.328850
C 2.028274 -2.538157 -0.537943
C 0.733868 -1.958701 -0.388438
C -0.387200 -2.763681 -0.113983
C 2.158930 -3.924990 -0.395335
C -1.674975 -2.122558 0.027748
C -0.222388 -4.162307 0.013996
C -1.797974 -0.770811 -0.076784
C 1.037175 -4.725289 -0.124743
C 2.038106 4.675772 -0.468043
C -0.634228 0.077282 -0.360844
C -3.087521 -0.122598 0.076502
H 1.651617 0.869303 0.839261
H 2.823001 1.340822 2.076093
H 3.532621 -0.821103 1.256870
H 4.689941 0.340027 0.617922
H 3.204449 2.270522 -0.841184
H 3.907853 2.958358 0.623311
H 4.176472 -0.354151 -1.556713
H 2.418124 -0.010082 -1.312126
H 0.870690 2.935139 -0.053703
H 1.569866 3.686742 1.385782
H 3.148898 -4.372221 -0.505631
H -2.551163 -2.755928 0.223989
H -1.089962 -4.787777 0.220254
H 1.170361 -5.803776 -0.024689
H 1.405146 6.561016 -0.450140
H -5.212632 2.056942 0.800926


%chk=000208858-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208858

0 1
O 2.843455 -1.566176 -0.933053
O 0.014180 -0.764559 -0.490276
O 3.655768 6.612322 -0.029180
O 4.937785 4.996687 -1.094004
O -1.537633 0.913727 -0.338736
N -4.299975 0.185724 0.208358
N -4.679017 -2.073275 0.489943
N -5.607851 -0.119798 0.469979
N -5.876464 -1.472955 0.646067
C 2.360008 1.892043 0.763188
C 2.717187 0.389986 0.642989
C 3.377720 2.838684 0.086331
C 2.741173 -0.079722 -0.820925
C 3.015474 4.317242 0.321191
C 1.797536 -2.424386 -0.613995
C 0.422403 -2.101723 -0.411503
C -0.540858 -3.119556 -0.131810
C 2.162713 -3.792296 -0.536318
C -1.906955 -2.712735 0.065213
C -0.135048 -4.482782 -0.063200
C -2.319698 -1.387781 0.004959
C 1.215043 -4.807988 -0.268864
C 3.975517 5.280681 -0.347625
C -1.353068 -0.312890 -0.269379
C -3.730305 -1.064897 0.225420
H 1.349874 2.054930 0.334835
H 2.288089 2.148706 1.839602
H 1.955997 -0.193450 1.193378
H 3.696927 0.184561 1.116282
H 3.423922 2.651137 -1.002677
H 4.395115 2.641419 0.476786
H 3.653253 0.252582 -1.341753
H 1.851030 0.275158 -1.364475
H 1.997368 4.537498 -0.057479
H 2.986743 4.557335 1.401886
H 3.218014 -4.033118 -0.696949
H -2.662744 -3.477836 0.275837
H -0.880863 -5.256015 0.147689
H 1.546957 -5.849558 -0.220999
H 4.296323 7.219686 -0.490315
H -6.333492 0.593787 0.531083


