%chk=000278718.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278718

0 1
O -4.358168 -2.198673 0.258567
O -6.480011 -1.823936 0.639310
O 1.956735 -2.701762 -0.854021
O 2.605321 3.527292 0.847612
O 1.567646 2.170855 -0.589009
N 0.859674 -0.669422 -0.992188
C -2.787961 -0.407188 -0.307601
C -3.866800 0.577900 -0.236817
C -3.088321 -1.757853 -0.058831
C -5.164381 0.129306 0.087713
C -1.454287 -0.078018 -0.614368
C -0.472138 -1.076812 -0.669795
C 3.908361 0.038811 -0.460095
C 3.238104 -0.747635 -1.409999
C -2.112795 -2.772935 -0.112232
C -0.807129 -2.431779 -0.418086
C -3.662292 1.951073 -0.480516
C 3.423905 0.137311 0.938512
C -5.440743 -1.290017 0.349191
C 1.987585 -1.502399 -1.049876
C -6.234506 1.042229 0.166783
C -4.725838 2.844369 -0.400489
C 5.076804 0.722187 -0.828884
C 2.663372 1.234912 1.381277
C 3.736858 -0.860132 -2.713403
C -6.016250 2.393454 -0.075758
C 3.758141 -0.876298 1.848496
C 5.568860 0.613494 -2.132175
C 4.902558 -0.178482 -3.073225
C 2.278506 1.334627 2.727055
C 3.354292 -0.785011 3.182898
C 2.622592 0.322870 3.625163
C 2.219055 2.279916 0.430795
H -1.193370 0.964208 -0.809621
H -2.404365 -3.805260 0.087492
H -0.029138 -3.206352 -0.465482
H -2.665008 2.310641 -0.735454
H 0.995975 0.350705 -1.139325
H -7.232516 0.671199 0.420003
H 5.601632 1.334058 -0.094760
H -4.559838 3.905698 -0.592003
H 3.216621 -1.483427 -3.443324
H -6.840722 3.102295 -0.016258
H 4.329014 -1.742190 1.505154
H 6.477180 1.146362 -2.414754
H 5.291748 -0.265937 -4.087395
H 1.710417 2.203206 3.066002
H 3.611757 -1.582416 3.882447
H 2.317907 0.394963 4.669306
H 2.308655 4.248792 0.224466


%chk=000278718-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000278718

0 1
O -4.420571 -2.216269 0.120135
O -6.605196 -1.706644 0.573063
O 1.975899 -2.918028 -1.368033
O 1.954591 3.664258 0.837540
O 1.521255 2.076333 -0.787456
N 0.932347 -0.830989 -0.998181
C -2.722769 -0.456265 -0.302823
C -3.761571 0.573277 -0.140991
C -3.098153 -1.821653 -0.171298
C -5.099577 0.162796 0.159614
C -1.361543 -0.176765 -0.584361
C -0.409343 -1.211947 -0.734135
C 3.784973 0.080028 -0.535370
C 3.305166 -0.877226 -1.473589
C -2.163992 -2.864361 -0.326893
C -0.820526 -2.573579 -0.610876
C -3.504647 1.966835 -0.272192
C 3.227486 0.215910 0.857085
C -5.469475 -1.265093 0.306803
C 2.025203 -1.652904 -1.258630
C -6.132830 1.122501 0.325750
C -4.533039 2.910963 -0.107740
C 4.949092 0.826671 -0.856403
C 2.543114 1.380603 1.321228
C 4.020816 -1.114171 -2.672501
C -5.855763 2.492911 0.194549
C 3.547835 -0.789769 1.803188
C 5.633707 0.617307 -2.072852
C 5.179084 -0.369838 -2.977500
C 2.254986 1.549531 2.701765
C 3.220553 -0.640353 3.169060
C 2.591650 0.541157 3.625568
C 1.989194 2.358661 0.352223
H -1.029054 0.860921 -0.695397
H -2.508479 -3.897051 -0.223090
H -0.085011 -3.367942 -0.746125
H -2.495473 2.316310 -0.510392
H 1.119287 0.187120 -1.030451
H -7.139926 0.760011 0.554940
H 5.332194 1.553006 -0.130462
H -4.310963 3.978328 -0.216490
H 3.649029 -1.880123 -3.360742
H -6.652486 3.232896 0.321414
H 4.074332 -1.686298 1.459764
H 6.529181 1.205337 -2.301776
H 5.719346 -0.553765 -3.912162
H 1.745211 2.460142 3.029933
H 3.472511 -1.437241 3.876948
H 2.355392 0.668311 4.686875
H 1.519653 4.254947 0.163965


