%chk=000289218.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289218

0 1
O 3.395367 -0.829561 -0.640395
O 1.527175 -2.330491 1.077027
N 4.411767 0.904089 0.631297
N -0.043050 -0.755808 1.546469
N -2.742169 1.293307 0.155159
C 5.608648 1.040120 -0.255400
C 5.319166 0.330860 -1.599728
C 4.649207 -1.010820 -1.356954
C 5.854854 2.538980 -0.490219
C 6.819093 0.408101 0.452180
C -1.120278 -1.788517 1.349844
C -0.553987 0.608276 1.195697
C 3.374872 -0.006333 0.450708
C -2.268143 -1.047017 0.734554
C -1.939451 0.369785 0.644297
C 1.299380 -1.139281 1.230828
C 2.280628 -0.062379 1.265112
C -3.479083 -1.480105 0.289903
C -4.391941 -0.508530 -0.253837
C -3.995300 0.858718 -0.304990
C -5.681116 -0.868700 -0.742992
C -4.887245 1.839141 -0.839643
C -6.524047 0.090970 -1.253967
C -6.123309 1.455566 -1.302189
H 6.253208 0.207189 -2.178746
H 4.660690 0.967100 -2.228478
H 4.410172 1.466107 1.480809
H 4.292930 -1.501624 -2.282931
H 5.265722 -1.712289 -0.767183
H 4.969649 3.037974 -0.905515
H 6.116110 3.066070 0.434540
H 6.680760 2.699421 -1.192669
H 7.032204 0.892998 1.412006
H 6.657908 -0.655645 0.667135
H 7.726132 0.487953 -0.156289
H -1.380751 -2.210864 2.345901
H -0.754223 -2.633422 0.720031
H 0.100510 1.131835 0.464701
H -0.590093 1.228139 2.119860
H 2.131743 0.686103 2.037176
H -3.776113 -2.525995 0.332032
H -5.983562 -1.914358 -0.704207
H -4.558367 2.879045 -0.866412
H -7.510180 -0.178673 -1.629049
H -6.814491 2.190962 -1.712574


%chk=000289218-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000289218

0 1
O 4.198801 -1.404631 -0.410066
O 1.521599 -2.431409 -0.189887
N 4.485448 0.746441 0.531503
N -0.092779 -0.798653 0.043710
N -3.029948 1.345360 0.188309
C 5.849029 1.032196 -0.013590
C 6.311992 -0.224540 -0.809204
C 5.670432 -1.484945 -0.221400
C 5.800758 2.272603 -0.944855
C 6.793418 1.300449 1.184671
C -1.144150 -1.837785 -0.116334
C -0.626160 0.574100 0.187929
C 3.611909 -0.247742 0.085349
C -2.422963 -1.035412 -0.067019
C -2.126527 0.361401 0.106026
C 1.254995 -1.191914 -0.010027
C 2.234862 -0.113756 0.165475
C -3.752594 -1.429542 -0.157819
C -4.774216 -0.421704 -0.076056
C -4.368590 0.962842 0.097078
C -6.170628 -0.728803 -0.158117
C -5.371103 1.979271 0.179244
C -7.129206 0.284512 -0.073895
C -6.726460 1.647460 0.095611
H 7.414698 -0.293702 -0.783824
H 6.003838 -0.143233 -1.867920
H 4.051237 1.504256 1.061806
H 5.958422 -2.399937 -0.760115
H 5.894011 -1.601892 0.856984
H 5.066664 2.119135 -1.755766
H 5.513705 3.181161 -0.382299
H 6.790981 2.456576 -1.401108
H 6.410243 2.124891 1.814942
H 6.885666 0.403483 1.822358
H 7.799135 1.586712 0.827144
H -1.073143 -2.595808 0.688778
H -1.006315 -2.387062 -1.068558
H -0.275278 1.249954 -0.618695
H -0.349300 1.038869 1.157116
H 1.871433 0.889207 0.412079
H -4.036309 -2.480542 -0.289233
H -6.477787 -1.773800 -0.288577
H -5.035068 3.012728 0.309070
H -8.195135 0.039738 -0.137664
H -7.488624 2.431862 0.159749


