%chk=000218714.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218714

0 1
O -3.014870 0.632619 0.647138
O 1.121750 -1.271354 -1.016092
N 4.465740 -0.367753 -0.180481
N 1.868597 0.659435 0.015971
C -5.094652 -2.068361 -0.867424
C -4.697898 -0.811894 -0.085931
C 3.466684 -0.821176 -1.192120
C 4.816122 -1.461945 0.786975
C 5.692400 0.188261 -0.848125
C -6.611910 -2.297728 -0.818263
C -3.188304 -0.591970 -0.139638
C 2.038461 -0.528039 -0.713743
C 3.606669 -1.863252 1.627443
C 6.471573 1.057454 0.138717
C -7.017317 -3.548212 -1.594792
C 0.638895 1.169800 0.533467
C -1.747523 1.125435 0.810275
C -0.591115 0.544702 0.277870
C 0.707055 2.347571 1.307616
C -1.708263 2.304115 1.585516
C -0.472219 2.896847 1.820998
H -4.763588 -1.981917 -1.920889
H -4.569320 -2.953281 -0.457750
H -5.217367 0.081956 -0.487363
H -5.024467 -0.886238 0.971303
H 3.525837 -1.909652 -1.426582
H 3.603357 -0.294670 -2.164552
H 5.241684 -2.356333 0.281164
H 5.612026 -1.063991 1.458458
H 6.351197 -0.604962 -1.263547
H 5.369269 0.817513 -1.708176
H -6.945529 -2.386344 0.234461
H -7.139852 -1.414568 -1.228984
H -2.615383 -1.401858 0.342485
H -2.813751 -0.407471 -1.160474
H 3.115168 -0.986751 2.071256
H 2.846391 -2.396289 1.042575
H 3.904888 -2.523055 2.450014
H 5.817064 1.797061 0.619322
H 6.926739 0.465302 0.941378
H 7.274603 1.602458 -0.369664
H -6.735750 -3.477185 -2.651666
H -6.541436 -4.448378 -1.189152
H -8.101261 -3.704527 -1.554588
H 2.724920 1.164183 0.293115
H -0.625993 -0.368825 -0.318707
H 1.656815 2.830617 1.507665
H -2.630595 2.719574 1.978014
H -0.419040 3.808374 2.418407


%chk=000218714-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218714

0 1
O -3.073184 0.713510 0.684008
O 0.977020 -1.794870 -0.778581
N 4.379924 -0.598431 0.041173
N 1.824136 -0.034203 0.563558
C -5.198280 -1.847802 -1.184852
C -4.821458 -0.610663 -0.337264
C 3.395856 -1.635291 -0.366545
C 5.580730 -1.157518 0.730891
C 4.717972 0.310136 -1.099739
C -6.723793 -1.986713 -1.393089
C -3.309107 -0.487580 -0.143560
C 1.929932 -1.159186 -0.229912
C 5.282089 -1.624302 2.167384
C 5.276517 1.672524 -0.650582
C -7.103216 -3.224445 -2.234198
C 0.668594 0.684999 0.963552
C -1.747119 1.033394 1.008422
C -0.634176 0.275097 0.575101
C 0.850695 1.836251 1.773256
C -1.578891 2.186549 1.816325
C -0.277917 2.575001 2.190740
H -4.699441 -1.789361 -2.174790
H -4.812828 -2.766870 -0.695928
H -5.197795 0.310144 -0.823335
H -5.306659 -0.671040 0.656013
H 3.501738 -2.525877 0.279441
H 3.533158 -1.983619 -1.412936
H 6.024013 -1.995288 0.140334
H 6.344669 -0.361142 0.769917
H 5.432943 -0.184922 -1.800389
H 3.783960 0.479942 -1.667350
H -7.222274 -2.041408 -0.403890
H -7.108502 -1.070231 -1.884942
H -2.898071 -1.379598 0.373121
H -2.788270 -0.375801 -1.117026
H 4.903492 -0.783815 2.775171
H 4.527593 -2.430995 2.195549
H 6.201893 -2.013652 2.641233
H 4.554104 2.191159 0.004754
H 6.230277 1.576245 -0.101832
H 5.463853 2.312324 -1.532150
H -6.640833 -3.178214 -3.238271
H -6.755390 -4.155690 -1.748339
H -8.197693 -3.302143 -2.369343
H 2.763801 0.287146 0.869548
H -0.733819 -0.615070 -0.048279
H 1.859386 2.144747 2.072130
H -2.462747 2.747848 2.132320
H -0.140379 3.464020 2.816082


