%chk=000250364.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250364

0 1
O 5.190283 1.585250 -0.207904
O 5.554454 -0.028594 1.330168
O -2.818609 -2.804480 0.640802
O -5.898334 1.077594 0.442707
C 2.446424 0.155125 -0.160707
C 1.602405 -1.061171 -0.663203
C 3.894538 -0.352309 -0.467070
C 2.355669 -2.282465 -0.111937
C 1.999862 1.371478 -0.983838
C 3.846743 -1.875430 -0.173503
C 0.149387 -0.848801 -0.360133
C 2.290722 0.426758 1.338927
C 0.489279 1.625936 -0.813951
C -0.374438 0.429251 -0.482353
C 4.947444 0.344384 0.355010
C -0.682986 -1.953577 -0.019171
C -1.783224 0.649849 -0.261001
C -2.621856 -0.443614 0.091228
C -2.019885 -1.745941 0.202713
C -2.389810 1.940163 -0.380681
C -4.006595 -0.250596 0.328716
C -3.732973 2.133981 -0.162758
C 6.172633 2.423967 0.453204
C -4.541507 1.018480 0.198416
C -3.392412 -3.583459 -0.439533
C -6.545829 2.369322 0.375610
H 1.675688 -1.104982 -1.785525
H 4.125533 -0.180396 -1.546735
H 2.156960 -3.190703 -0.701027
H 2.050459 -2.505733 0.925789
H 2.236576 1.218616 -2.053737
H 2.572809 2.270167 -0.684188
H 4.355412 -2.108064 0.782070
H 4.383852 -2.435750 -0.955118
H 1.235953 0.526587 1.624631
H 2.704030 -0.387016 1.947831
H 2.795648 1.351331 1.637556
H 0.106936 2.095896 -1.744644
H 0.353575 2.379059 -0.006310
H -0.256731 -2.950185 0.076516
H -1.768751 2.794475 -0.653111
H -4.625210 -1.097156 0.627838
H -4.172110 3.121938 -0.261325
H 7.074222 1.845109 0.681779
H 5.731482 2.827294 1.369300
H 6.365145 3.205616 -0.288220
H -3.982751 -4.330914 0.103168
H -2.599401 -4.054158 -1.026192
H -4.030707 -2.951449 -1.063735
H -6.478662 2.777926 -0.636320
H -6.123892 3.047946 1.122146
H -7.583645 2.110446 0.625408


%chk=000250364-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250364

0 1
O 5.300264 1.511248 -0.395722
O 5.532832 -0.113884 1.253331
O -3.166234 -2.722195 -0.035875
O -6.113837 1.238454 0.260535
C 2.389251 0.175182 -0.120486
C 1.508988 -0.974690 -0.701317
C 3.813413 -0.370401 -0.519865
C 2.200927 -2.268121 -0.206755
C 1.948198 1.476166 -0.822092
C 3.726337 -1.911623 -0.258854
C 0.025908 -0.744200 -0.463589
C 2.266532 0.305606 1.419397
C 0.453922 1.788451 -0.522316
C -0.470964 0.570966 -0.429937
C 4.955313 0.297349 0.220244
C -0.858451 -1.865401 -0.331707
C -1.893171 0.776845 -0.252857
C -2.793118 -0.351985 -0.126998
C -2.231710 -1.681581 -0.170553
C -2.478053 2.083399 -0.190327
C -4.192150 -0.149196 0.041482
C -3.852862 2.278271 -0.022645
C 6.382430 2.279080 0.266715
C -4.719602 1.146989 0.092510
C -2.656562 -4.092423 -0.064725
C -6.704768 2.575543 0.324188
H 1.668670 -0.940670 -1.804453
H 3.952776 -0.162465 -1.597922
H 1.964162 -3.143019 -0.838384
H 1.885617 -2.510339 0.824921
H 2.091434 1.354380 -1.915112
H 2.575374 2.333371 -0.513061
H 4.233029 -2.160000 0.689563
H 4.246158 -2.466068 -1.060316
H 1.212549 0.413521 1.726270
H 2.685295 -0.569742 1.944983
H 2.819099 1.195328 1.774811
H 0.081298 2.484486 -1.300443
H 0.385693 2.349989 0.433135
H -0.429911 -2.871134 -0.359722
H -1.833761 2.963652 -0.274072
H -4.858758 -1.009122 0.133891
H -4.251118 3.296675 0.018754
H 7.316740 1.692709 0.273946
H 6.102758 2.520334 1.306199
H 6.491205 3.190411 -0.337987
H -3.542136 -4.733750 0.055268
H -1.947033 -4.274660 0.766049
H -2.160363 -4.315613 -1.029626
H -6.531966 3.142173 -0.612084
H -6.312378 3.153487 1.184085
H -7.783461 2.405220 0.457128


