%chk=000287180.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287180

0 1
O -2.871458 -2.334599 0.505892
O -5.232413 -1.413040 0.226876
O -5.557156 0.726029 -0.336674
N -1.408747 1.375358 -0.501803
N 6.018114 0.176856 -0.007577
C -0.488789 0.332766 -0.174208
C -0.995229 -0.938889 0.163562
C -0.930850 2.759578 -0.804128
C 0.905054 0.558920 -0.200648
C 1.775525 -0.488801 0.097342
C -2.768588 1.149724 -0.428783
C -2.461175 -1.231254 0.217590
C -3.306358 -0.072747 -0.104341
C -0.093618 -1.977859 0.463722
C 1.277951 -1.764228 0.429986
C 3.240442 -0.258860 0.062903
C -0.775249 3.581318 0.468852
C -4.765926 -0.170559 -0.093985
C 4.045380 -0.958771 -0.846857
C 3.836964 0.659116 0.938867
C 5.427230 -0.709555 -0.850488
C 5.227254 0.844120 0.872426
H 0.037171 2.696433 -1.356513
H -1.651901 3.246110 -1.501934
H 1.307952 1.537506 -0.457943
H -3.436021 2.002611 -0.660415
H -0.505492 -2.961809 0.724242
H 1.969170 -2.573080 0.664793
H -1.727727 3.706351 1.001809
H -0.074718 3.118293 1.177577
H -0.395767 4.587182 0.245034
H 3.609832 -1.677707 -1.537907
H 3.238925 1.208664 1.661832
H 6.096474 -1.231020 -1.546021
H 5.739123 1.547539 1.540520
H -6.230980 -1.443497 0.224603


%chk=000287180-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287180

0 1
O -2.883486 -2.493949 0.341794
O -5.426920 -1.383660 0.064408
O -5.553493 0.885427 -0.365732
N -1.448415 1.380320 -0.390308
N 6.098299 0.234318 -0.033383
C -0.518500 0.332102 -0.155442
C -1.023874 -0.983602 0.081842
C -1.001063 2.785409 -0.607743
C 0.882340 0.564205 -0.167965
C 1.793990 -0.495009 0.041213
C -2.793071 1.114711 -0.361171
C -2.491651 -1.304771 0.116711
C -3.360510 -0.137168 -0.126467
C -0.097055 -2.035365 0.293091
C 1.284247 -1.807243 0.272137
C 3.262466 -0.242748 0.019654
C -0.664924 3.518700 0.706620
C -4.844650 -0.141811 -0.157998
C 4.172472 -1.215881 -0.475528
C 3.822428 0.975838 0.491086
C 5.556263 -0.937986 -0.482159
C 5.220042 1.166751 0.444671
H -0.137204 2.780188 -1.294904
H -1.818509 3.308654 -1.132196
H 1.277095 1.563114 -0.371043
H -3.465710 1.959985 -0.540863
H -0.516132 -3.029700 0.479359
H 1.977392 -2.631952 0.466500
H -1.550761 3.571842 1.362960
H 0.142048 3.012544 1.263342
H -0.337814 4.550588 0.486439
H 3.810661 -2.167594 -0.877707
H 3.186338 1.756674 0.921483
H 6.270433 -1.675378 -0.865475
H 5.668128 2.097933 0.809604
H -6.416500 -1.267288 0.021372


