%chk=000217954.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217954

0 1
O -0.181889 2.759615 -0.368256
O 3.292853 -0.205353 0.292786
N -0.739030 0.535386 -0.314225
N 1.567734 1.268837 -0.032245
N -1.026678 -1.952442 -0.136841
C -0.288448 -0.775883 -0.135314
C 1.075314 -1.092471 0.068431
C 0.213989 1.615393 -0.238260
C 2.099447 -0.080633 0.128810
C -2.179233 0.845064 -0.520824
C 1.161604 -2.518451 0.193167
C -0.116796 -3.030175 0.070325
C 2.517708 2.415158 0.019869
C -3.015361 0.402570 0.647656
C -4.216467 -0.151968 0.507388
H -2.283485 1.959673 -0.648967
H -2.510655 0.389726 -1.482127
H -2.023237 -2.033956 -0.227295
H 2.075924 -3.061929 0.353765
H -0.463884 -4.045432 0.107393
H 2.476081 2.995693 -0.917315
H 3.549095 2.037449 0.160512
H 2.267823 3.087303 0.858047
H -2.572588 0.593919 1.629395
H -4.833997 -0.438503 1.349466
H -4.692525 -0.345593 -0.443741


%chk=000217954-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000217954

0 1
O -0.152032 2.842718 -0.313281
O 3.361426 -0.253275 0.175811
N -0.723258 0.573083 -0.192172
N 1.577092 1.280116 -0.046808
N -1.030132 -1.886570 -0.035538
C -0.268338 -0.733543 -0.061807
C 1.087957 -1.087348 0.061128
C 0.221647 1.637937 -0.190069
C 2.115120 -0.066537 0.072347
C -2.147752 0.896254 -0.444167
C 1.146415 -2.525245 0.169167
C -0.161704 -2.995940 0.110572
C 2.536170 2.409312 -0.037233
C -3.077528 0.379997 0.636775
C -4.226600 -0.299002 0.388749
H -2.183028 2.001536 -0.487291
H -2.449260 0.507266 -1.436818
H -2.049696 -1.914169 -0.012193
H 2.051896 -3.117866 0.274572
H -0.556713 -4.007629 0.159007
H 2.457631 2.982966 -0.975130
H 3.541753 1.976725 0.068473
H 2.316107 3.087325 0.803638
H -2.789676 0.624733 1.669380
H -4.898682 -0.600678 1.198825
H -4.545514 -0.539169 -0.634336


