%chk=000211570.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211570

0 1
O 0.443954 0.331927 -0.579836
O 3.083778 0.859209 -0.177181
N -2.896297 0.773498 0.402213
C -4.100703 0.303739 -0.360571
C -3.258657 1.857042 1.375342
C -5.152546 -0.247515 0.616238
C -4.301515 1.330256 2.375297
C -5.550272 0.811390 1.651929
C -1.821314 1.231311 -0.534458
C -0.957434 0.006833 -0.901502
C -0.867737 -0.254757 -2.396215
C 0.883504 0.200419 0.707842
C 2.279058 0.407528 0.876128
C 0.098265 -0.108337 1.824467
C 2.874403 0.301493 2.131119
C 0.703735 -0.209044 3.081818
C 2.076491 -0.006257 3.240360
C 3.378808 -0.028629 -1.205973
C 3.106523 -1.401035 -1.180665
C 4.038418 0.590137 -2.284347
C 3.511335 -2.171798 -2.274442
C 4.430420 -0.205708 -3.357757
C 4.169832 -1.583679 -3.357979
H -3.772940 -0.503470 -1.050284
H -4.550231 1.104366 -0.986803
H -3.642028 2.772070 0.875515
H -2.333253 2.144373 1.922048
H -4.743280 -1.138348 1.133669
H -6.038753 -0.591920 0.053418
H -4.570358 2.131585 3.087142
H -3.853946 0.513636 2.976655
H -6.080758 1.647595 1.158692
H -6.262595 0.382980 2.380982
H -2.207678 1.736538 -1.443205
H -1.165303 1.984030 -0.038226
H -1.250597 -0.903080 -0.332763
H -0.197678 -1.100977 -2.606514
H -0.441509 0.606506 -2.930419
H -1.848452 -0.478122 -2.826830
H -0.979452 -0.257160 1.723651
H 3.946545 0.466703 2.232500
H 0.088194 -0.448533 3.948913
H 2.532218 -0.086743 4.224411
H 2.592172 -1.853442 -0.337990
H 4.225481 1.660163 -2.260949
H 3.311503 -3.242875 -2.276934
H 4.943641 0.247953 -4.205155
H 4.481908 -2.192851 -4.201453


%chk=000211570-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000211570

0 1
O 0.536452 0.471406 -0.629179
O 3.237396 0.770228 -0.123569
N -2.862572 0.868521 0.474769
C -3.940282 0.147183 -0.255371
C -3.417885 1.949514 1.335583
C -4.960264 -0.471499 0.721654
C -4.418204 1.380299 2.361206
C -5.554680 0.611483 1.649750
C -1.804786 1.367806 -0.439986
C -0.892962 0.223100 -0.975191
C -0.891880 0.090800 -2.499547
C 0.950498 0.288268 0.693702
C 2.354265 0.398179 0.923030
C 0.091307 0.012355 1.786698
C 2.881418 0.255011 2.218484
C 0.633458 -0.140374 3.084756
C 2.022101 -0.016513 3.309365
C 3.461834 -0.114294 -1.207002
C 3.096665 -1.479649 -1.187849
C 4.140099 0.442468 -2.314482
C 3.414038 -2.289272 -2.301885
C 4.451022 -0.379318 -3.418212
C 4.089278 -1.748427 -3.420515
H -3.482232 -0.647725 -0.873050
H -4.474428 0.842921 -0.956282
H -3.931703 2.732831 0.718789
H -2.573480 2.439660 1.855701
H -4.449486 -1.242181 1.330832
H -5.759519 -0.975845 0.145366
H -4.827129 2.207966 2.971707
H -3.878290 0.695363 3.043570
H -6.157441 1.321978 1.046837
H -6.238170 0.155479 2.390392
H -2.239284 1.929692 -1.303390
H -1.172183 2.080605 0.119082
H -1.197684 -0.729056 -0.494101
H -0.218845 -0.722406 -2.819028
H -0.544092 1.029069 -2.966706
H -1.912818 -0.123477 -2.865220
H -0.993602 -0.047325 1.630359
H 3.962763 0.359896 2.351651
H -0.041639 -0.348504 3.922433
H 2.435996 -0.127642 4.316749
H 2.580087 -1.901458 -0.319784
H 4.407825 1.503132 -2.293022
H 3.134491 -3.349125 -2.289869
H 4.976360 0.051142 -4.278277
H 4.333089 -2.383266 -4.279051


