%chk=000218435.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218435

0 1
O 2.868427 -0.093310 0.808861
O 1.902784 2.527462 0.176684
O 0.887349 -2.071335 0.987954
O 2.576452 -0.321154 -1.427702
O -4.002010 0.632659 0.824922
N -0.119564 1.649642 -0.342204
N -0.684827 -0.662042 0.100169
N -2.182854 0.698269 -1.169839
N -3.145005 -0.329484 -1.117626
N -4.714039 -1.491332 0.310263
C 1.496624 0.263817 0.993644
C 1.186242 1.563058 0.249895
C 0.570349 -0.954665 0.684807
C -0.978216 0.523091 -0.404244
C 3.315011 -0.410983 -0.481176
C 4.736960 -0.812686 -0.375603
C -3.956279 -0.349244 0.101966
H 1.465360 0.463997 2.101641
H -0.338705 2.509041 -0.862155
H -2.642515 1.625139 -1.054944
H -2.724126 -1.238176 -1.400641
H 4.865225 -1.869303 -0.669522
H 5.135053 -0.706263 0.648975
H 5.368255 -0.206136 -1.046688
H -5.412321 -1.479493 1.041998
H -4.757330 -2.255369 -0.341336


%chk=000218435-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218435

0 1
O 3.150906 -0.062435 0.776975
O 2.060016 2.496565 0.085609
O 1.303559 -2.179906 0.905631
O 2.551322 -0.262230 -1.460054
O -4.777973 0.910031 -0.738143
N -0.065587 1.569448 -0.005143
N -0.513437 -0.774675 0.490662
N -2.221786 0.626345 -0.157993
N -3.061012 -0.491154 -0.084576
N -5.224678 -1.366344 -0.361287
C 1.738516 0.229970 1.039809
C 1.305936 1.524325 0.316178
C 0.831055 -1.024507 0.776131
C -0.903464 0.452079 0.128617
C 3.432041 -0.344969 -0.576697
C 4.872741 -0.743881 -0.745786
C -4.395617 -0.263404 -0.415451
H 1.718310 0.429631 2.128519
H -0.390866 2.429169 -0.459228
H -2.722755 1.477942 -0.443986
H -2.551265 -1.346406 0.176578
H 5.019543 -1.757988 -0.332703
H 5.530481 -0.057999 -0.187450
H 5.136835 -0.744653 -1.812849
H -6.202611 -1.221910 -0.598782
H -4.903912 -2.297845 -0.106484


