%chk=000297651.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297651

0 1
O -1.374683 2.919738 1.810914
O 4.208973 0.989005 -1.240187
O -1.391971 -1.963099 -1.500445
C 0.510362 1.695484 -1.204518
C 0.139012 0.212883 -0.940158
C 0.256621 2.530305 0.060202
C 1.966713 1.787304 -1.673193
C -1.297202 0.136458 -0.476727
C 1.124306 -0.452466 0.004669
C -1.228784 2.514069 0.442019
C 2.940338 1.251497 -0.615287
C -1.917978 1.180303 0.213526
C 2.445988 0.018341 0.111250
C -2.078895 -1.015429 -0.765532
C 0.752577 -1.590271 0.739967
C -3.243698 1.050766 0.670247
C 3.364391 -0.644619 0.940468
C -3.398325 -1.150460 -0.330747
C 1.668568 -2.241016 1.567252
C -3.970256 -0.105252 0.406986
C 2.981889 -1.770464 1.668479
C -2.108440 -3.151221 -1.913234
H -0.147162 2.079047 -2.024474
H 0.217307 -0.350583 -1.914926
H 0.593890 3.573800 -0.082166
H 0.859195 2.142392 0.906432
H 2.232991 2.832147 -1.923720
H 2.095713 1.225287 -2.619027
H -1.789610 3.320216 -0.095102
H 3.213910 2.049880 0.118321
H -0.261225 -1.983237 0.658273
H -3.689726 1.869845 1.236242
H 4.388627 -0.270804 1.003905
H -1.002831 2.244457 2.415895
H 4.162791 0.193093 -1.806114
H -3.981765 -2.038010 -0.549605
H 1.360010 -3.118890 2.132426
H -4.994615 -0.201555 0.766483
H 3.698930 -2.278299 2.309370
H -2.423835 -3.728000 -1.039227
H -1.337410 -3.689031 -2.480981
H -2.953391 -2.884514 -2.554360


%chk=000297651-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000297651

0 1
O -1.488593 3.079892 1.794900
O 4.340262 1.140670 -1.162123
O -1.431551 -2.021641 -1.512133
C 0.527120 1.700448 -1.181042
C 0.139933 0.216721 -0.936954
C 0.263942 2.514904 0.108587
C 1.987226 1.782396 -1.673860
C -1.312588 0.126418 -0.462579
C 1.166316 -0.471525 -0.001399
C -1.239562 2.544898 0.434995
C 2.974783 1.290458 -0.602862
C -1.943379 1.201012 0.218605
C 2.506006 0.013027 0.098964
C -2.096503 -1.028673 -0.762577
C 0.815996 -1.630549 0.737765
C -3.291369 1.085294 0.650560
C 3.444946 -0.671344 0.913735
C -3.440967 -1.143070 -0.344183
C 1.754149 -2.303397 1.547686
C -4.028323 -0.081143 0.381393
C 3.081931 -1.825714 1.634766
C -2.191615 -3.209691 -1.903245
H -0.129805 2.096836 -1.982894
H 0.198837 -0.322194 -1.905130
H 0.632145 3.552433 0.009706
H 0.806083 2.052878 0.957311
H 2.253932 2.815373 -1.963309
H 2.094546 1.150437 -2.580291
H -1.736710 3.300973 -0.202221
H 3.129281 2.083268 0.152892
H -0.205522 -2.013215 0.674788
H -3.742741 1.923804 1.190298
H 4.466246 -0.278209 0.968544
H -1.130872 2.427395 2.451115
H 4.331776 0.371537 -1.788792
H -4.030508 -2.035020 -0.574506
H 1.450003 -3.195626 2.106969
H -5.067895 -0.166270 0.716603
H 3.819370 -2.341981 2.259510
H -2.533858 -3.781089 -1.018500
H -1.487149 -3.820099 -2.487197
H -3.064020 -2.941524 -2.530299


