%chk=000253201.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253201

0 1
O -2.107001 -0.067723 -2.191143
O -4.471913 0.673937 -1.411451
O 4.289021 0.379022 0.064939
O -5.181855 -1.336519 2.294694
O 4.355641 -1.866317 0.340936
C -0.569043 1.122588 -0.072402
C 0.753844 1.116935 0.701383
C -1.145076 -0.323345 -0.027716
C 1.787973 0.176582 -0.001909
C -2.465885 -0.385933 -0.834931
C -3.494033 0.694555 -0.338671
C -0.128696 -1.358224 -0.558683
C 1.252360 -1.259119 0.107930
C -1.576830 2.124074 0.515032
C 3.056600 0.482668 0.849892
C 1.526695 2.432722 0.901617
C -2.881009 2.103823 -0.286254
C 2.970300 1.979114 1.220905
C -3.133379 -1.778450 -0.847103
C -4.173557 0.312565 0.980443
C 2.054457 0.542096 -1.467200
C -3.727749 -2.151605 0.509157
C -4.764821 -1.100350 0.931349
C 4.840086 -0.864812 -0.131420
C 6.062132 -0.709549 -0.998940
C 7.204217 -1.572650 -0.481162
H -0.384805 1.388361 -1.145314
H 0.543240 0.703218 1.721833
H -1.385509 -0.579279 1.033074
H -0.027093 -1.225818 -1.657162
H -0.529946 -2.379299 -0.413537
H 1.191502 -1.572385 1.166617
H 1.959858 -1.971770 -0.361193
H -1.146511 3.143726 0.495061
H -1.772822 1.901463 1.580758
H 3.161445 -0.188976 1.722785
H 1.102576 3.040337 1.714868
H 1.498825 3.056758 -0.007390
H -3.599938 2.829692 0.132255
H -2.681621 2.433093 -1.329185
H 3.712190 2.555613 0.637485
H 3.219686 2.137127 2.281573
H -2.400726 -2.540013 -1.176100
H -3.927411 -1.775997 -1.623731
H -4.969212 1.034695 1.244686
H -3.448559 0.375246 1.819773
H 1.121998 0.583440 -2.046429
H 2.546159 1.516913 -1.556884
H 2.707830 -0.195692 -1.943430
H -4.190050 -3.154312 0.458787
H -2.934082 -2.226806 1.279158
H -5.667850 -1.139231 0.283080
H -2.918130 0.134060 -2.717847
H -5.177680 1.325745 -1.261831
H -5.550671 -2.230910 2.396464
H 5.790725 -0.998552 -2.038032
H 6.364728 0.359094 -1.053136
H 6.890953 -2.620500 -0.359799
H 8.055918 -1.557648 -1.171275
H 7.563303 -1.227980 0.496826


%chk=000253201-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253201

0 1
O -2.370987 0.180089 -2.270576
O -4.755919 0.670658 -1.127624
O 4.328553 0.327619 -0.106921
O -4.904576 -1.725026 2.495156
O 4.543268 -1.641121 1.142551
C -0.644307 1.238047 -0.161521
C 0.755663 1.251467 0.475706
C -1.168874 -0.234791 -0.200066
C 1.784120 0.367830 -0.302778
C -2.569772 -0.305315 -0.886359
C -3.593169 0.653867 -0.176200
C -0.151067 -1.210988 -0.856860
C 1.282185 -1.093904 -0.272113
C -1.641965 2.141480 0.598335
C 3.039282 0.663960 0.566534
C 1.493828 2.604186 0.676747
C -3.037617 2.090257 -0.060939
C 2.998314 2.193078 0.842846
C -3.173956 -1.734282 -0.946933
C -4.071459 0.102597 1.186036
C 2.016443 0.838833 -1.762359
C -3.569322 -2.276974 0.445821
C -4.599574 -1.336889 1.102273
C 4.971103 -0.860688 0.261093
C 6.232187 -1.051754 -0.570272
C 7.202690 -2.076522 0.045611
H -0.583148 1.604264 -1.205369
H 0.652262 0.787312 1.485811
H -1.297448 -0.552640 0.858350
H -0.143502 -1.031761 -1.947590
H -0.492698 -2.253587 -0.712863
H 1.286339 -1.455149 0.777104
H 1.964818 -1.758808 -0.836920
H -1.281103 3.187599 0.601173
H -1.701133 1.824365 1.660519
H 2.992343 0.071044 1.499878
H 1.117110 3.157329 1.554795
H 1.357674 3.259669 -0.204139
H -3.758257 2.715501 0.507116
H -2.963129 2.506050 -1.084383
H 3.646771 2.711769 0.115099
H 3.386633 2.425005 1.849670
H -2.465095 -2.411180 -1.452145
H -4.078656 -1.685493 -1.583367
H -4.866517 0.759686 1.589616
H -3.245418 0.119466 1.921269
H 1.106083 0.725162 -2.373755
H 2.329888 1.896203 -1.815357
H 2.817160 0.236015 -2.226046
H -3.998549 -3.294363 0.342760
H -2.686741 -2.363735 1.109443
H -5.529095 -1.351158 0.493188
H -3.285084 0.374642 -2.613760
H -5.342162 1.432730 -0.891183
H -5.248342 -2.654433 2.496558
H 5.911196 -1.381928 -1.578969
H 6.709248 -0.065804 -0.713698
H 6.691917 -3.036730 0.229293
H 8.057145 -2.253027 -0.631209
H 7.595219 -1.720234 1.014024


