%chk=000201463.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201463

1 1
O 1.201532 0.517496 1.335725
O 1.033374 -1.353550 0.091364
N 4.358740 0.229661 -0.114699
N -4.199407 -0.958144 -1.008392
N -5.168168 0.979514 -0.337846
C 3.528043 0.991488 0.920241
C 3.485157 -0.300486 -1.224282
C 5.374216 1.188151 -0.705464
C 5.093274 -0.918812 0.540330
C 2.537171 0.141649 1.725361
C 0.468720 -0.376306 0.544842
C -0.891649 0.105834 0.414058
C -1.836408 -0.622077 -0.224179
C -3.193494 -0.186604 -0.372658
C -3.838004 1.008035 0.029760
C -5.377384 -0.213887 -0.962538
H 4.221478 1.516080 1.621179
H 2.948492 1.803209 0.405080
H 2.733939 -1.040915 -0.845044
H 2.907027 0.502031 -1.716353
H 4.071469 -0.817729 -2.004353
H 6.066156 1.584214 0.061214
H 5.996719 0.698106 -1.479281
H 4.885443 2.054746 -1.190755
H 5.720175 -0.579772 1.385409
H 4.389918 -1.682874 0.930978
H 5.758337 -1.440879 -0.174611
H 2.680623 -0.952725 1.624561
H 2.558636 0.421261 2.802352
H -1.106189 1.073150 0.880785
H -1.579059 -1.600950 -0.660089
H -4.066985 -1.873350 -1.402401
H -3.410923 1.852866 0.549291
H -6.326168 -0.546734 -1.370683


%chk=000201463-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201463

1 1
O 1.317341 0.936864 1.286735
O 1.108743 -1.264080 0.504060
N 4.252775 0.247689 -0.163766
N -3.978581 -1.306883 -0.886299
N -5.182839 0.596414 -0.661502
C 3.825871 1.061038 1.089331
C 3.272936 0.449919 -1.321832
C 5.626946 0.768008 -0.589694
C 4.352500 -1.246811 0.153932
C 2.612214 0.577253 1.891294
C 0.560676 -0.142035 0.724821
C -0.802781 0.270301 0.461687
C -1.711724 -0.623295 -0.074094
C -3.086472 -0.341302 -0.363152
C -3.884254 0.828507 -0.241350
C -5.210897 -0.708752 -1.043764
H 4.703324 1.049297 1.761399
H 3.662377 2.096956 0.744976
H 2.317874 -0.024838 -1.066126
H 3.138126 1.527735 -1.497418
H 3.693918 -0.028653 -2.219652
H 6.356646 0.563869 0.208670
H 5.933632 0.253680 -1.512866
H 5.562766 1.851955 -0.771562
H 4.999203 -1.383804 1.034754
H 3.339867 -1.637463 0.341315
H 4.797336 -1.755912 -0.715245
H 2.642566 -0.504710 2.104502
H 2.638322 1.129341 2.847181
H -1.073713 1.294840 0.728405
H -1.340115 -1.637557 -0.285218
H -3.749452 -2.278753 -1.097609
H -3.582711 1.808244 0.123933
H -6.087617 -1.225365 -1.426945


