%chk=000296058.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296058

0 1
O -3.064170 -1.093325 1.213167
O -2.572158 2.293337 -0.206357
O 0.447426 0.804116 2.117052
O -1.565948 -1.769263 -0.354934
O -1.124829 1.282753 -1.636214
N 0.896463 -0.132255 0.043167
C -1.418244 0.459179 0.652597
C 0.079407 0.402562 1.034409
C -1.977157 -0.929834 0.407466
C -1.646221 1.354491 -0.550876
C 2.319445 -0.300334 0.133892
C 2.968124 -0.864522 -0.984809
C 3.051682 0.072103 1.272400
C -3.753097 -2.392640 1.188988
C -2.924360 3.315196 -1.203947
C 4.349554 -1.049459 -0.948591
C 4.434803 -0.122975 1.285084
C 5.087485 -0.680997 0.182448
C -2.942443 -3.415982 1.950771
C -1.815699 4.337893 -1.302269
H -1.955640 0.913037 1.548792
H 0.456428 -0.440637 -0.841980
H 2.403752 -1.154373 -1.868988
H 2.550699 0.509923 2.141336
H -3.925453 -2.675067 0.135599
H -4.701797 -2.120096 1.688441
H -3.854070 3.713460 -0.755855
H -3.130864 2.808189 -2.162793
H 4.856473 -1.484797 -1.809614
H 5.006355 0.165163 2.167654
H 6.164557 -0.828866 0.201954
H -2.650783 -3.046479 2.943625
H -2.014888 -3.675289 1.417279
H -3.505381 -4.346465 2.096572
H -0.913304 3.912234 -1.767779
H -1.521052 4.714551 -0.312985
H -2.118393 5.201268 -1.908000


%chk=000296058-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296058

0 1
O -3.076551 -1.188156 1.316889
O -2.548243 2.428649 -0.206589
O 0.401477 0.860549 2.289002
O -1.568306 -1.678649 -0.399484
O -1.145713 1.185886 -1.602535
N 0.839148 -0.068880 0.163521
C -1.482737 0.509876 0.754419
C 0.031168 0.451840 1.151165
C -2.020488 -0.898121 0.470681
C -1.684982 1.384460 -0.488331
C 2.249671 -0.264973 0.187311
C 2.843567 -0.822380 -0.977218
C 3.060461 0.069344 1.305044
C -3.682155 -2.558323 1.189046
C -2.811425 3.401641 -1.322285
C 4.234132 -1.043695 -1.025634
C 4.452191 -0.159382 1.238967
C 5.048804 -0.713318 0.083235
C -2.901033 -3.569077 2.030979
C -1.725665 4.478746 -1.360811
H -2.023409 0.945479 1.603326
H 0.353031 -0.347307 -0.699916
H 2.214755 -1.079719 -1.838551
H 2.599490 0.497465 2.197059
H -3.689375 -2.836165 0.120585
H -4.710073 -2.412738 1.555853
H -3.800469 3.812706 -1.066997
H -2.860931 2.837378 -2.269895
H 4.680725 -1.473902 -1.928787
H 5.074032 0.099910 2.103272
H 6.129764 -0.885392 0.045473
H -2.844190 -3.244955 3.084052
H -1.878020 -3.701470 1.641074
H -3.411085 -4.549588 1.998109
H -0.746991 4.044539 -1.624798
H -1.640596 4.988045 -0.385790
H -1.983275 5.235478 -2.124739


