%chk=000252679.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252679

0 1
O -1.029646 -1.789012 -0.021285
O -3.219370 -1.848297 -0.061446
O -4.558869 0.443278 -0.122073
O -3.489130 2.415800 -0.131429
O 4.944759 -0.057490 0.066612
O 4.026414 1.903257 0.019801
N 3.979085 0.684613 0.037119
C 0.230788 0.266420 -0.027997
C 0.149890 -1.152946 -0.008383
C 1.509140 0.866222 -0.012587
C -0.992053 1.015189 -0.062523
C 2.642041 0.061454 0.020935
C 1.313153 -1.967459 0.025823
C -2.202145 0.380041 -0.076038
C 2.547509 -1.360920 0.040274
C -2.323192 -1.068611 -0.056427
C -3.425514 1.206525 -0.111920
H 1.608645 1.960824 -0.026965
H -0.943860 2.116307 -0.078156
H 1.196771 -3.054250 0.039761
H 3.474814 -1.950930 0.066672
H -5.391028 0.998884 -0.146468


%chk=000252679-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000252679

0 1
O -1.039254 -1.863873 -0.019957
O -3.340545 -1.897418 -0.062746
O -4.654774 0.538099 -0.126451
O -3.366935 2.465409 -0.128281
O 5.028982 -0.026176 0.066660
O 4.012708 2.018143 0.019238
N 3.981019 0.727537 0.036078
C 0.231659 0.224339 -0.027490
C 0.172865 -1.205926 -0.007024
C 1.500940 0.859728 -0.012925
C -1.011471 0.947178 -0.061999
C 2.656099 0.066107 0.020871
C 1.349582 -1.992319 0.027113
C -2.245738 0.314658 -0.075958
C 2.597039 -1.354625 0.041113
C -2.357814 -1.155452 -0.055491
C -3.444430 1.210943 -0.112595
H 1.591053 1.950117 -0.027459
H -1.007569 2.043871 -0.078486
H 1.260846 -3.081474 0.041848
H 3.530206 -1.923266 0.067343
H -5.396265 1.203301 -0.150102


