%chk=000252478.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252478

0 1
O 0.538895 2.333034 -0.000419
O 0.373729 -2.447481 0.000737
O 2.641601 1.106268 0.000255
O 2.731673 -1.054033 0.000060
N -1.495064 -1.179889 0.000130
N -1.465706 1.196456 -0.000311
N 2.128302 -0.001081 0.000182
C 0.671039 -0.036325 0.000027
C -2.152832 0.036908 -0.000189
C -0.013203 -1.310495 0.000197
C -0.077504 1.149967 -0.000238
C -3.637938 0.077593 -0.000733
H -2.017778 -2.065930 0.000205
H -4.018050 0.647398 0.870132
H -4.121541 -0.908883 0.015116
H -4.017768 0.619365 -0.889338
H -0.123855 3.107927 -0.000613


%chk=000252478-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000252478

0 1
O 0.489244 2.412016 -0.000397
O 0.384587 -2.496492 0.000700
O 2.754293 1.113645 0.002554
O 2.756790 -1.164624 -0.002948
N -1.491047 -1.137628 0.000643
N -1.464208 1.211786 0.000333
N 2.144829 -0.028372 -0.000217
C 0.672900 -0.029332 0.000024
C -2.145607 0.061985 0.000486
C -0.042199 -1.316924 0.000360
C -0.078589 1.167426 0.000038
C -3.650996 0.087664 -0.001026
H -2.008721 -2.023690 0.000930
H -4.013352 0.649306 0.876554
H -4.087295 -0.924027 0.015969
H -4.012329 0.618339 -0.898350
H -0.264301 3.069719 -0.000454


