%chk=000244742.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244742

0 1
O 0.697015 0.692018 2.314444
O 4.404617 -2.405068 0.528966
N -0.494961 2.273812 -0.294244
N -1.458704 2.957992 0.046059
C -1.842037 0.812142 1.097935
C -0.521506 0.872713 0.261228
C -2.425655 2.248485 0.938857
C -2.777431 -0.258516 0.606619
C 0.734526 0.627729 1.108756
C -3.150262 -1.300053 1.468898
C -3.280005 -0.232069 -0.704286
C 1.969509 0.247796 0.350212
C -4.017891 -2.302298 1.024506
C -4.146428 -1.235505 -1.143499
C 2.662615 -0.892587 0.752670
C 2.423934 1.025974 -0.725479
C -4.517595 -2.272342 -0.280589
C 3.826437 -1.253744 0.042119
C 3.585899 0.652882 -1.403719
C 4.299150 -0.492777 -1.034406
C 5.628836 -2.862871 -0.094259
H -1.585035 0.640847 2.175403
H -0.535862 0.152128 -0.594883
H -3.437735 2.266381 0.488256
H -2.498873 2.785601 1.905526
H -2.764615 -1.333873 2.487269
H -2.995462 0.571700 -1.382319
H -4.303645 -3.108578 1.698864
H -4.533749 -1.210167 -2.161223
H 2.338145 -1.495040 1.600916
H 1.879390 1.923200 -1.026818
H -5.192965 -3.053235 -0.625023
H 3.943666 1.261166 -2.235534
H 5.197294 -0.771073 -1.575789
H 6.417891 -2.114172 0.020165
H 5.450720 -3.115253 -1.143243
H 5.854072 -3.762845 0.493844


%chk=000244742-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244742

0 1
O 0.682404 -0.140829 2.279840
O 5.263206 -1.705398 0.941658
N -0.363683 1.899889 -0.273797
N -1.163087 2.723627 0.286148
C -1.838394 0.521036 1.173487
C -0.572384 0.450262 0.274329
C -2.078302 2.060710 1.295502
C -3.027399 -0.234781 0.594797
C 0.710727 0.014925 1.023467
C -3.608596 -1.315264 1.305117
C -3.575613 0.120294 -0.667451
C 1.954540 -0.229945 0.230070
C -4.709157 -2.024433 0.771914
C -4.674215 -0.585809 -1.203018
C 3.049734 -0.836591 0.891669
C 2.064284 0.128533 -1.144402
C -5.246095 -1.662313 -0.484550
C 4.247382 -1.097842 0.190932
C 3.265249 -0.132473 -1.830706
C 4.360210 -0.747887 -1.180482
C 6.535238 -1.981743 0.268451
H -1.580468 0.106555 2.162644
H -0.703430 -0.186856 -0.618606
H -3.112506 2.371062 1.066829
H -1.809475 2.468562 2.286796
H -3.194206 -1.602258 2.279428
H -3.144646 0.956006 -1.234723
H -5.145729 -2.856857 1.335267
H -5.085047 -0.298169 -2.177432
H 2.966428 -1.101796 1.949740
H 1.243854 0.643130 -1.650096
H -6.099269 -2.210979 -0.898658
H 3.361537 0.150057 -2.884567
H 5.280050 -0.942776 -1.739974
H 7.008890 -1.049532 -0.096426
H 6.400687 -2.686553 -0.575233
H 7.170583 -2.443062 1.038234


