%chk=000220767.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220767

0 1
O 4.351292 -1.030189 -1.453693
O -3.953898 1.431181 -0.027044
O 3.806768 1.128184 -1.176988
N 2.343252 0.305636 1.258610
N -3.041337 -0.678341 -0.221622
C 1.008027 0.062991 0.787867
C -1.681620 -0.386502 0.125387
C 0.086438 1.131777 0.784074
C 0.571347 -1.230959 0.450434
C -1.247806 0.909976 0.461559
C -0.763339 -1.455455 0.120311
C 3.428112 -0.487640 0.653153
C -4.101720 0.251819 -0.276820
C 3.847253 0.014499 -0.716928
C -5.419135 -0.358172 -0.672093
H 0.411599 2.140420 1.038487
H 1.270189 -2.066510 0.454298
H -1.957676 1.747046 0.466090
H -1.084112 -2.462756 -0.137485
H 2.583810 1.306163 1.275486
H 3.150660 -1.570358 0.599153
H 4.316212 -0.442298 1.334561
H -3.235997 -1.655488 -0.442842
H -5.392666 -0.809598 -1.672221
H -6.196115 0.425631 -0.697440
H -5.761855 -1.120136 0.039822
H 4.654516 -0.755821 -2.361217


%chk=000220767-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000220767

0 1
O 4.648175 -1.505635 -1.048388
O -4.227139 1.347271 0.414121
O 3.736854 0.569859 -1.582793
N 2.361953 0.523682 1.017507
N -3.075086 -0.578084 -0.281987
C 1.026354 0.247680 0.666298
C -1.723733 -0.259660 0.053548
C 0.016725 1.213697 0.939053
C 0.630769 -0.983019 0.071902
C -1.335182 0.976478 0.638991
C -0.724955 -1.227011 -0.221707
C 3.460624 -0.366268 0.716577
C -4.224958 0.190575 -0.105062
C 3.920938 -0.340822 -0.753849
C -5.503583 -0.492706 -0.598634
H 0.297896 2.169983 1.398025
H 1.368833 -1.752438 -0.176686
H -2.097538 1.727562 0.852661
H -1.003374 -2.184835 -0.681597
H 2.589683 1.496590 1.217879
H 3.220034 -1.409376 0.987519
H 4.341879 -0.089123 1.326127
H -3.210211 -1.495860 -0.712972
H -5.445482 -0.728850 -1.677647
H -6.348761 0.190369 -0.432394
H -5.696051 -1.433723 -0.050028
H 4.987536 -1.461239 -1.983566


