%chk=000212492.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212492

0 1
O 3.757491 -0.711600 -0.089870
O 3.950808 1.555829 0.068697
N -0.543116 0.538236 -0.396096
N 2.246690 0.595353 -1.220131
N -4.004516 -0.299868 0.809500
C 0.300840 -0.698696 -0.303279
C 0.291551 1.760089 -0.147975
C -1.696873 0.476621 0.558979
C 1.418381 -0.634312 -1.364102
C 1.417281 1.835942 -1.199193
C -2.839658 -0.310002 -0.121799
C -5.346924 -0.512305 0.171074
C -6.376058 -0.558804 1.320225
C -5.653006 0.677857 -0.754858
C -5.415710 -1.832985 -0.629098
C 3.348043 0.580894 -0.339884
C 5.048346 -0.876805 0.622980
C 4.799574 -0.648196 2.103456
C 5.430979 -2.303399 0.266521
H 0.743585 -0.851918 0.704704
H -0.349510 -1.576399 -0.508105
H -0.364511 2.652013 -0.254549
H 0.723666 1.794847 0.875284
H -1.436800 0.025851 1.538689
H -2.060619 1.505074 0.781212
H 2.069275 -1.535087 -1.299914
H 0.976473 -0.610173 -2.387283
H 0.985873 1.953490 -2.219998
H 2.070494 2.717624 -1.005975
H -3.106569 0.194104 -1.078281
H -2.505381 -1.333590 -0.390468
H -3.853274 -0.984212 1.556916
H -6.291268 0.331620 1.956294
H -7.398514 -0.588416 0.931929
H -6.242925 -1.434607 1.961294
H -4.954547 0.730221 -1.597433
H -5.565155 1.625432 -0.208101
H -6.665170 0.616481 -1.163165
H -5.155036 -2.696873 -0.012206
H -6.424873 -2.004546 -1.017113
H -4.740637 -1.822412 -1.489733
H 5.754595 -0.126849 0.201361
H 5.689672 -0.871606 2.701326
H 4.528375 0.402275 2.292406
H 3.978286 -1.269173 2.479413
H 6.387605 -2.583082 0.721514
H 5.520824 -2.428840 -0.820737
H 4.673344 -3.021398 0.606372


%chk=000212492-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212492

0 1
O 3.997926 -0.858419 -0.055901
O 4.241163 1.486118 -0.042447
N -0.681800 0.669959 -0.044855
N 2.154131 0.477812 -0.411073
N -4.372231 0.042562 0.570210
C 0.033653 -0.591285 0.271635
C 0.191840 1.838553 0.233741
C -2.013612 0.763899 0.601161
C 1.310285 -0.720937 -0.583001
C 1.466319 1.765811 -0.627398
C -3.090159 -0.038724 -0.160979
C -5.609497 -0.497273 -0.081602
C -6.749559 -0.329867 0.952959
C -5.935351 0.344925 -1.340669
C -5.479295 -2.001092 -0.473502
C 3.510732 0.461083 -0.160953
C 5.462442 -0.984873 0.256605
C 5.669730 -0.842982 1.771405
C 5.875576 -2.349057 -0.302050
H 0.314231 -0.636003 1.356092
H -0.627841 -1.449150 0.056444
H -0.360508 2.762324 -0.017700
H 0.483951 1.892587 1.313607
H -1.979756 0.424213 1.669882
H -2.328999 1.822575 0.617353
H 1.888769 -1.609908 -0.293480
H 1.018310 -0.813734 -1.649178
H 1.183761 1.855124 -1.695980
H 2.167666 2.576526 -0.373233
H -3.210336 0.416817 -1.158876
H -2.731362 -1.083986 -0.326014
H -4.277051 -0.341504 1.522688
H -6.863538 0.734278 1.224547
H -7.707983 -0.698384 0.545569
H -6.533481 -0.901263 1.877403
H -5.183174 0.202397 -2.137756
H -5.966087 1.417053 -1.078747
H -6.917416 0.050046 -1.752873
H -5.282550 -2.624122 0.420257
H -6.408824 -2.367749 -0.947748
H -4.652796 -2.157373 -1.191127
H 5.977844 -0.160620 -0.270291
H 6.740889 -0.959586 2.020410
H 5.343839 0.153712 2.113118
H 5.099719 -1.617546 2.315401
H 6.955384 -2.513181 -0.133067
H 5.678289 -2.404380 -1.386303
H 5.318154 -3.161677 0.197118


