%chk=000185774.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185774

0 1
O 1.013291 -0.840707 0.228996
O -0.613973 -0.772589 1.845021
O -0.738119 2.521113 0.603464
O 2.681204 0.113675 1.550897
O -0.727373 3.939148 -1.620398
O 3.915169 -2.710053 1.132514
O 3.729603 -1.746982 -1.999608
O 4.254527 1.102544 -1.670180
O -4.428449 -2.059794 -0.661689
O 3.165170 3.183254 1.582570
O -4.102106 -3.088964 1.325134
C -0.902140 0.289688 -0.459140
C -1.248019 1.819345 -0.548667
C -2.272780 -0.451763 -0.541383
C -0.031624 -0.015416 0.753062
C -2.756623 1.878696 -0.614034
C -3.306414 0.662174 -0.593342
C -2.541292 -1.408439 0.578074
C 2.121147 -1.108919 1.102515
C -0.538245 2.529201 -1.721517
C 3.086854 -1.966381 0.250140
C 3.929861 -1.118416 -0.729132
C 3.422986 0.342001 -0.801652
C 3.352299 0.977190 0.598235
C -1.730686 -1.513149 1.653658
C -3.725546 -2.274930 0.509252
C 2.595509 2.316962 0.601243
C -5.610282 -2.883675 -0.856399
H -0.308738 -0.010847 -1.364750
H -2.316468 -1.024424 -1.508081
H 0.397753 0.868521 1.294652
H -3.247088 2.837545 -0.688409
H -4.356205 0.400288 -0.626212
H 1.783813 -1.585998 2.049159
H -0.990572 2.271354 -2.698246
H 0.544836 2.309551 -1.734379
H 2.530528 -2.761557 -0.318157
H 5.012819 -1.174608 -0.480034
H 2.431170 0.369589 -1.324096
H 4.364927 1.112609 1.048441
H -1.874399 -2.161779 2.524249
H -1.417175 2.577213 1.312045
H 1.509356 2.177862 0.794932
H 2.747448 2.874622 -0.346459
H -0.455023 4.243028 -0.717085
H 4.441650 -2.116749 1.715402
H 4.075516 -1.166079 -2.720078
H 5.137325 1.275138 -1.275105
H 2.944942 2.863225 2.485202
H -6.012991 -2.501109 -1.799675
H -6.304224 -2.740171 -0.021833
H -5.312051 -3.934237 -0.932919


%chk=000185774-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185774

0 1
O 0.941306 -0.433513 0.269692
O -0.731366 -0.204207 1.970502
O -1.733599 2.616028 1.461473
O 2.993511 0.420516 1.242683
O -1.690286 4.717678 -0.260070
O 3.315686 -2.723412 1.842290
O 3.790979 -2.790950 -1.376032
O 4.639032 -0.159550 -2.132471
O -3.870072 -2.254506 -1.059700
O 2.977410 3.122651 0.458695
O -3.656292 -3.147195 1.087529
C -0.988115 0.902368 -0.289811
C -1.723383 2.260700 0.010333
C -2.094840 -0.149263 -0.663288
C -0.045501 0.478541 0.835252
C -3.123987 2.024861 -0.513989
C -3.326274 0.734733 -0.881950
C -2.350306 -1.184084 0.426183
C 2.069224 -0.713282 1.171935
C -1.004145 3.480288 -0.610448
C 2.764642 -2.006703 0.688335
C 3.837120 -1.718419 -0.390538
C 3.621484 -0.354396 -1.077895
C 3.650060 0.800068 -0.057636
C -1.709813 -1.133242 1.631288
C -3.327842 -2.278531 0.238970
C 2.984231 2.085823 -0.571703
C -4.833117 -3.340331 -1.357957
H -0.355176 1.056307 -1.183003
H -1.834327 -0.678857 -1.597679
H 0.436392 1.336214 1.334449
H -3.848458 2.841726 -0.565889
H -4.251816 0.312343 -1.280771
H 1.710234 -0.841054 2.207624
H -1.030294 3.416525 -1.710770
H 0.054795 3.500249 -0.268053
H 2.010964 -2.688464 0.267055
H 4.837839 -1.689000 0.108049
H 2.671904 -0.372562 -1.637785
H 4.694604 1.023688 0.242260
H -1.925709 -1.829322 2.446917
H -2.328634 1.995585 1.953073
H 1.955742 1.851708 -0.917024
H 3.557736 2.497018 -1.418894
H -1.797021 4.702956 0.727905
H 4.031765 -2.171258 2.251416
H 4.307614 -2.486737 -2.169714
H 5.527867 -0.026300 -1.708322
H 2.701170 2.690724 1.310303
H -5.124851 -3.178018 -2.405138
H -5.705029 -3.274498 -0.685596
H -4.351958 -4.323842 -1.225890


