%chk=000256654.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256654

0 1
O 4.722617 -1.386428 -1.070221
O 2.701802 -2.086259 -1.367750
N -0.286655 0.691951 -1.707159
N -0.016540 -1.427592 -0.503824
N 3.518103 -1.295115 -0.912256
C 0.669348 -0.311811 -1.181342
C -1.978106 -0.042830 -0.098389
C -1.489799 0.955187 -1.007638
C -1.248277 -1.260394 0.135609
C 1.686464 0.300296 -0.189787
C -3.231548 0.149097 0.539200
C -2.209550 2.118189 -1.240286
C -1.768726 -2.251308 0.963749
C 3.013959 -0.161021 -0.105332
C -3.954177 1.357605 0.283787
C -3.732600 -0.872291 1.399287
C 1.295145 1.333931 0.671458
C -3.453881 2.299104 -0.583650
C -3.018752 -2.036203 1.587297
C 3.935170 0.429183 0.780361
C 2.200840 1.912265 1.564612
C 3.527179 1.468188 1.613088
H 1.216926 -0.728517 -2.086400
H 0.147016 1.472529 -2.198741
H 0.500642 -2.302081 -0.442521
H -1.858626 2.879214 -1.927266
H -1.237961 -3.180108 1.137444
H -4.908733 1.507040 0.781084
H -4.688984 -0.720745 1.890727
H 0.259655 1.689538 0.665663
H -4.011325 3.215525 -0.783849
H -3.412787 -2.821285 2.235379
H 4.968747 0.064058 0.808719
H 1.869344 2.713369 2.229283
H 4.236471 1.927118 2.302965


%chk=000256654-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000256654

0 1
O 4.753793 -1.588267 -0.895070
O 2.592847 -2.225872 -1.243518
N -0.291118 0.771012 -1.666936
N -0.053906 -1.393218 -0.675992
N 3.482335 -1.392582 -0.774317
C 0.673351 -0.237730 -1.231755
C -1.985608 -0.028660 -0.108058
C -1.514554 0.982518 -1.016448
C -1.226847 -1.241724 0.062606
C 1.697279 0.318335 -0.202266
C -3.244341 0.142661 0.572503
C -2.289948 2.135970 -1.247618
C -1.714955 -2.254351 0.914108
C 3.016687 -0.202131 -0.038291
C -4.001854 1.337328 0.332003
C -3.707282 -0.902676 1.438138
C 1.348514 1.427764 0.610653
C -3.530992 2.300793 -0.567650
C -2.952860 -2.072830 1.592332
C 3.950349 0.371435 0.861908
C 2.252906 1.984128 1.537218
C 3.564841 1.461762 1.657980
H 1.228942 -0.591915 -2.116360
H 0.014297 1.440583 -2.371428
H 0.511797 -2.240665 -0.596321
H -1.939585 2.905566 -1.945846
H -1.142780 -3.179231 1.050096
H -4.957469 1.476031 0.849282
H -4.660017 -0.778857 1.964321
H 0.353313 1.867167 0.499408
H -4.119687 3.205656 -0.756189
H -3.314176 -2.871111 2.250536
H 4.953420 -0.059179 0.921765
H 1.940889 2.832267 2.155820
H 4.274820 1.899421 2.366690


