%chk=000296195.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296195

0 1
O -2.971973 2.000062 -1.832365
O 2.927872 1.455756 1.582169
O 4.219290 0.188706 -0.732279
N -1.486020 -2.037267 0.603789
C -1.362425 -0.566239 0.327256
C -1.887459 0.094321 1.609827
C -2.213862 0.041870 -0.816188
C -2.310014 -2.241711 1.839546
C -2.085582 -0.955287 2.663934
C 0.125689 -0.350252 0.042468
C -1.986210 1.560199 -0.860530
C -1.824217 -2.916343 -0.542468
C -2.254866 2.279024 0.479776
C -2.275386 1.370528 1.669678
C 0.758720 -0.998873 -1.044303
C -0.539373 -3.154678 -1.360006
C 0.011890 -1.880855 -2.013287
C 0.874661 0.484134 0.879631
C 2.133735 -0.821214 -1.253583
C 2.243155 0.672202 0.656976
C 2.879854 0.003866 -0.406251
C -2.663522 3.248001 -2.474887
C 3.526186 2.649392 1.007081
C 5.141886 -0.243892 0.305638
H -3.288914 -0.170280 -0.659355
H -1.961276 -0.397742 -1.803619
H -1.923536 -3.141056 2.359175
H -3.387264 -2.399978 1.636690
H -1.183354 -1.044841 3.300983
H -2.932472 -0.739436 3.334548
H -0.967167 1.795477 -1.236324
H -2.632895 -2.516926 -1.189919
H -2.190295 -3.892901 -0.154597
H -3.242599 2.788339 0.405724
H -1.508238 3.082515 0.633650
H -2.667041 1.813151 2.583284
H -0.744190 -3.912890 -2.138817
H 0.236816 -3.588832 -0.694730
H -0.820605 -1.295811 -2.473315
H 0.668568 -2.165123 -2.860745
H 0.415414 0.997849 1.726130
H 2.646793 -1.323660 -2.072708
H -1.725335 3.172048 -3.032654
H -2.624891 4.061214 -1.745226
H -3.510185 3.382940 -3.159407
H 4.100059 3.050910 1.848344
H 2.734434 3.337479 0.700666
H 4.174580 2.388559 0.162650
H 5.104326 -1.333674 0.385529
H 4.899247 0.231770 1.263135
H 6.106692 0.095651 -0.083715


%chk=000296195-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296195

0 1
O -2.831881 2.141147 -1.997291
O 2.939296 1.642084 1.420083
O 4.330388 0.094098 -0.663697
N -1.669113 -2.011362 0.524709
C -1.391131 -0.563643 0.264576
C -1.856163 0.066276 1.590718
C -2.242818 0.094490 -0.873628
C -2.330065 -2.227033 1.827225
C -1.847624 -1.010471 2.658210
C 0.129338 -0.378945 -0.018439
C -2.088982 1.624019 -0.830072
C -1.891751 -2.951687 -0.572184
C -2.619746 2.223804 0.496874
C -2.416866 1.296364 1.681729
C 0.800493 -1.117553 -1.048803
C -0.587547 -3.319300 -1.316305
C 0.116287 -2.111410 -1.989786
C 0.880443 0.534172 0.757920
C 2.194217 -0.926104 -1.214447
C 2.264971 0.724931 0.572805
C 2.940724 -0.036854 -0.414076
C -2.564308 3.551812 -2.272887
C 3.542494 2.793213 0.711234
C 5.192441 -0.305228 0.472353
H -3.308721 -0.168967 -0.732368
H -1.941609 -0.244209 -1.878429
H -2.018278 -3.195453 2.264280
H -3.446762 -2.222053 1.767468
H -0.823928 -1.202401 3.032805
H -2.505861 -0.780651 3.512521
H -1.014270 1.882389 -0.954036
H -2.637133 -2.572727 -1.312614
H -2.327301 -3.874035 -0.141972
H -3.708746 2.407439 0.375597
H -2.157954 3.212154 0.696468
H -2.809689 1.637296 2.650548
H -0.832300 -4.061923 -2.104079
H 0.108884 -3.801090 -0.604549
H -0.623720 -1.591367 -2.631022
H 0.884447 -2.504542 -2.681737
H 0.390256 1.123348 1.539593
H 2.738750 -1.487206 -1.982463
H -1.474663 3.742125 -2.383095
H -2.964504 4.218404 -1.480773
H -3.072540 3.779103 -3.223771
H 4.059515 3.379472 1.486642
H 2.751116 3.408249 0.240949
H 4.257692 2.454103 -0.060245
H 5.063230 -1.383362 0.686783
H 4.955315 0.285499 1.375820
H 6.224381 -0.110214 0.141858


