%chk=000242316.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242316

0 1
O -4.620637 -1.190868 1.448099
O -5.943927 -0.961630 -0.509008
O 3.038887 -0.462574 2.228277
O 1.405848 -3.170817 -1.422429
O 3.172229 -2.821560 0.870906
O 1.231862 3.420939 0.251634
O 1.598501 3.115851 -1.961940
C -2.097324 0.532996 -0.652243
C -0.706703 1.053247 -0.633886
C 0.341240 0.066048 -0.263099
C -3.889484 -0.552079 0.455172
C -2.594786 -0.096442 0.521682
C -4.687360 -0.413346 -0.722410
C -2.877535 0.666768 -1.802170
C 0.449889 -1.120453 -0.980669
C 1.192098 0.340526 0.821002
C -4.206905 0.187533 -1.863376
C 2.151076 -0.605763 1.188038
C 1.438698 -2.064911 -0.620231
C 2.297349 -1.823832 0.470288
C -0.454393 2.334807 -0.935626
C -5.934567 -1.475524 0.864590
C 0.887901 2.949582 -1.000417
C 2.952220 0.746944 3.023114
C 2.351074 -4.244285 -1.169696
C 4.570048 -2.419808 0.897266
C 2.486301 4.161376 0.379431
C 3.662214 3.207999 0.367973
H -1.978608 -0.209724 1.411077
H -2.458539 1.145321 -2.689048
H -0.206333 -1.345348 -1.820544
H 1.092065 1.288008 1.349104
H -4.807108 0.290572 -2.762971
H -1.255863 3.039466 -1.184590
H -6.053712 -2.566059 0.816955
H -6.686099 -0.917026 1.437704
H 1.968452 0.825295 3.494850
H 3.736257 0.579015 3.771408
H 3.175999 1.625465 2.394933
H 3.368059 -3.895594 -1.366845
H 2.253788 -4.599664 -0.136664
H 2.026975 -4.998585 -1.895393
H 4.720494 -1.658861 1.672998
H 5.069183 -3.357336 1.162125
H 4.881148 -2.055910 -0.083537
H 2.538500 4.903883 -0.437339
H 2.334708 4.660678 1.353423
H 4.608087 3.730675 0.547511
H 3.554910 2.418835 1.131956
H 3.746624 2.699173 -0.606185


%chk=000242316-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242316

0 1
O -4.665356 -1.917481 0.665807
O -6.021275 -0.799977 -0.971340
O 2.890131 -0.475988 2.923384
O 1.386967 -3.236957 -0.846542
O 3.070301 -2.872763 1.527650
O 1.932511 2.434055 -0.609574
O 0.903892 4.447575 -0.024223
C -2.101292 0.630361 -0.422713
C -0.714084 1.116497 -0.160954
C 0.303009 0.106281 0.252972
C -3.931178 -0.875890 0.041972
C -2.621463 -0.487580 0.307784
C -4.734939 -0.217431 -0.914617
C -2.920968 1.277239 -1.392918
C 0.428599 -1.113681 -0.443392
C 1.130466 0.349780 1.380960
C -4.252565 0.866243 -1.653672
C 2.070895 -0.613547 1.787406
C 1.394882 -2.076653 -0.062597
C 2.229204 -1.842334 1.068263
C -0.461631 2.473248 -0.249670
C -5.960534 -1.977437 -0.058058
C 0.818211 3.207643 -0.253941
C 2.688293 0.711020 3.759704
C 2.595615 -4.068633 -0.978785
C 4.511005 -2.561884 1.654218
C 3.236107 3.155401 -0.686121
C 3.426154 3.790653 -2.067576
H -2.015268 -1.004000 1.055264
H -2.497035 2.096660 -1.981329
H -0.191044 -1.333243 -1.317009
H 1.008943 1.282996 1.935848
H -4.869939 1.362561 -2.406196
H -1.312644 3.157950 -0.339727
H -5.996011 -2.900668 -0.664759
H -6.784252 -1.906521 0.669826
H 1.651124 0.756377 4.142822
H 3.390272 0.592714 4.598257
H 2.920022 1.640875 3.204972
H 3.481847 -3.447908 -1.213632
H 2.783295 -4.646835 -0.061137
H 2.374769 -4.736433 -1.826491
H 4.669170 -1.743557 2.374561
H 4.973467 -3.492073 2.018405
H 4.934361 -2.290091 0.666574
H 3.267860 3.921692 0.109050
H 3.980429 2.366102 -0.489801
H 4.436607 4.234918 -2.141240
H 3.321282 3.033757 -2.864080
H 2.684591 4.589973 -2.232406


