%chk=000185880.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185880

0 1
O 0.424960 -0.763109 0.177593
O -2.447970 1.447094 1.737805
O 2.195381 2.891901 -0.474259
O 4.500707 1.657300 -0.469782
O 4.437240 -3.113306 0.182982
O -5.623058 -1.049971 -0.980796
C -0.345200 0.500748 0.318997
C 0.210736 1.584453 -0.590358
C -1.746890 0.097389 -0.024173
C 2.451027 0.541662 -0.191724
C 1.708195 1.787407 -0.405191
C 1.770421 -0.680257 0.047975
C -2.834399 0.595122 0.734986
C -2.016561 -0.784239 -1.080339
C 3.862399 0.479968 -0.259586
C 2.438566 -1.907773 0.162973
C -4.159065 0.243147 0.451593
C 4.576901 -0.721535 -0.138023
C 3.832863 -1.896993 0.063235
C -3.320107 -1.162412 -1.392816
C -4.369081 -0.639994 -0.619019
C -3.467401 1.994955 2.611662
H -0.237575 0.768024 1.398665
H -0.326007 2.541064 -0.409081
H 0.019021 1.354850 -1.660154
H -1.177979 -1.187259 -1.657240
H 1.891119 -2.830710 0.335433
H -4.988219 0.627773 1.027906
H 5.654217 -0.741735 -0.197229
H -3.537927 -1.847671 -2.207890
H 5.489441 1.555752 -0.519313
H -3.978913 1.190576 3.147849
H -4.161091 2.616801 2.038775
H -2.864459 2.605818 3.297819
H 5.425404 -3.057957 0.113835
H -6.330894 -0.662180 -0.407909


%chk=000185880-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185880

0 1
O 0.472547 -0.945056 -0.183997
O -2.364406 1.551575 1.585160
O 2.051778 2.944735 -0.105851
O 4.530594 1.800982 0.066287
O 4.706724 -3.085384 -0.203881
O -5.874851 -0.971802 -0.836465
C -0.350299 0.219513 0.257531
C 0.140910 1.485179 -0.465064
C -1.799538 -0.119507 -0.023175
C 2.468364 0.536452 -0.083698
C 1.627049 1.756090 -0.186585
C 1.855520 -0.764527 -0.150593
C -2.822122 0.589646 0.665864
C -2.184535 -1.095766 -0.967326
C 3.899707 0.561005 -0.020063
C 2.603578 -1.955655 -0.197865
C -4.189709 0.328326 0.418672
C 4.666154 -0.624894 -0.059751
C 4.006764 -1.874174 -0.159450
C -3.541200 -1.375482 -1.232768
C -4.536064 -0.658763 -0.536920
C -3.358645 2.291566 2.364891
H -0.191871 0.340345 1.348512
H -0.443261 2.359632 -0.135880
H -0.007067 1.363169 -1.556708
H -1.400112 -1.655461 -1.483662
H 2.100710 -2.923078 -0.241744
H -4.974134 0.877685 0.951304
H 5.762751 -0.574393 -0.012754
H -3.839486 -2.135573 -1.959256
H 5.515989 1.688110 0.060006
H -3.973904 1.608732 2.982415
H -4.013769 2.896430 1.708326
H -2.774505 2.957055 3.016959
H 5.684092 -2.938530 -0.158867
H -6.497951 -0.423476 -0.298405


