%chk=000180725.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180725

0 1
O 4.188943 -0.889822 0.135503
O -0.555452 1.685315 -0.260126
N -0.618969 -0.614182 -0.075269
N 3.142983 -0.910705 -0.789416
C -1.843264 -0.764371 0.792580
C -3.071014 -0.614827 -0.114136
C -1.859005 0.292812 1.904984
C -1.743824 -2.158570 1.441254
C -0.094675 0.586600 -0.527278
C 1.145622 0.444222 -1.414489
C -3.394687 0.653820 -0.624046
C -3.876639 -1.707702 -0.459240
C 2.344635 0.141522 -0.599158
C 2.843674 0.938268 0.518926
C -4.506813 0.826389 -1.449636
C -4.992394 -1.534339 -1.285942
C 4.008703 0.245876 0.941444
C -5.312018 -0.268308 -1.781661
C 2.447836 2.103553 1.185895
C 4.812722 0.669933 2.001631
C 3.238426 2.538849 2.244713
C 4.400139 1.834933 2.642383
H -0.162119 -1.486529 -0.343499
H -1.003856 0.187867 2.580864
H -1.812679 1.317863 1.498935
H -2.774881 0.221005 2.500950
H -0.849535 -2.244714 2.071518
H -1.709725 -2.971269 0.707456
H -2.607916 -2.342132 2.092906
H 0.989640 -0.308151 -2.218956
H 1.296799 1.413125 -1.953148
H -2.762204 1.515630 -0.379844
H -3.650384 -2.707190 -0.092481
H -4.745393 1.815986 -1.836066
H -5.611611 -2.391694 -1.542957
H -6.180208 -0.134062 -2.423429
H 1.542988 2.634320 0.877311
H 5.700246 0.120103 2.299097
H 2.962866 3.442833 2.786941
H 4.985740 2.221146 3.478686


%chk=000180725-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000180725

0 1
O 2.920285 -1.112307 1.013657
O -1.627751 2.321268 0.266981
N -1.078583 0.057367 0.626559
N 1.631962 -0.544719 0.567445
C -2.410715 -0.542148 0.993398
C -3.246739 -0.804458 -0.289370
C -3.191147 0.388155 1.962881
C -2.061404 -1.848572 1.750066
C -0.791056 1.363672 0.328714
C 0.690134 1.688672 -0.017326
C -3.654243 0.292889 -1.098535
C -3.635453 -2.109175 -0.685526
C 1.804348 0.786824 0.449147
C 3.163277 1.173376 0.785920
C -4.420894 0.085118 -2.264506
C -4.406909 -2.317794 -1.852912
C 3.817861 -0.038788 1.128618
C -4.803651 -1.221685 -2.648973
C 3.877398 2.396844 0.835990
C 5.164747 -0.109869 1.524213
C 5.229018 2.352340 1.229551
C 5.860296 1.117306 1.567552
H -0.285571 -0.605272 0.595922
H -2.592493 0.576667 2.872651
H -3.424228 1.357128 1.499067
H -4.133494 -0.108286 2.255126
H -1.461740 -1.606245 2.644702
H -1.477574 -2.549007 1.124533
H -2.979664 -2.361013 2.082690
H 0.730396 1.771949 -1.122597
H 0.862642 2.708790 0.366365
H -3.357575 1.308353 -0.814729
H -3.342679 -2.979268 -0.089924
H -4.721381 0.945708 -2.873262
H -4.695852 -3.336404 -2.136987
H -5.401607 -1.381396 -3.553473
H 3.397792 3.346334 0.577529
H 5.641089 -1.058639 1.783116
H 5.810811 3.278361 1.279331
H 6.913046 1.121328 1.869596


