%chk=000251816.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251816

0 1
O -1.995041 -0.516421 -0.408634
O 0.127567 -1.404658 1.067859
O -1.889388 1.685706 0.096235
N 1.571238 0.013104 0.034159
C 2.568266 -0.161977 1.130421
C 1.857481 1.076827 -0.962327
C -0.667023 -0.458940 -1.014909
C 0.350664 -0.654803 0.131060
C -0.634989 -1.641038 -1.962995
C 3.742778 -1.023036 0.670117
C 1.245204 2.416458 -0.561046
C -2.489485 0.636799 0.164600
C -3.797713 0.333740 0.800821
H 2.918757 0.835419 1.472748
H 2.060849 -0.647266 2.002175
H 2.962457 1.175373 -1.067592
H 1.483884 0.758497 -1.961075
H -0.570939 0.522818 -1.530769
H 0.347428 -1.757571 -2.435046
H -1.390913 -1.539114 -2.752362
H -0.862417 -2.577679 -1.425965
H 3.403377 -2.016622 0.347642
H 4.283517 -0.575359 -0.170047
H 4.458604 -1.172264 1.486767
H 0.157728 2.340956 -0.380072
H 1.679675 2.804082 0.367645
H 1.393124 3.173166 -1.338080
H -3.703121 0.357168 1.900236
H -4.172976 -0.668149 0.532409
H -4.558494 1.077483 0.519924


%chk=000251816-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251816

0 1
O -2.056849 -0.573329 -0.508198
O 0.077412 -1.322395 1.108889
O -1.834529 1.538912 0.448898
N 1.529710 0.129583 0.012031
C 2.520527 -0.019445 1.109194
C 1.851294 1.104688 -1.058629
C -0.676842 -0.438930 -1.050349
C 0.334058 -0.560306 0.124526
C -0.511074 -1.594169 -2.044210
C 3.538629 -1.144846 0.831336
C 1.379965 2.538161 -0.723598
C -2.497912 0.487058 0.290633
C -3.833171 0.163525 0.916073
H 3.035121 0.951181 1.237453
H 1.962529 -0.241685 2.034151
H 2.948384 1.087702 -1.200941
H 1.416831 0.768632 -2.016533
H -0.611406 0.546512 -1.541505
H 0.486333 -1.557170 -2.518288
H -1.280093 -1.536060 -2.832991
H -0.612800 -2.556630 -1.515726
H 3.019653 -2.115427 0.754825
H 4.093713 -0.967430 -0.108486
H 4.273079 -1.209354 1.655182
H 0.291086 2.560360 -0.544678
H 1.876001 2.909886 0.191161
H 1.626344 3.229080 -1.551013
H -3.662498 -0.468592 1.806589
H -4.467084 -0.407065 0.218939
H -4.336311 1.090253 1.229165


