%chk=000183629.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183629

0 1
O 1.324786 1.386800 0.231926
O -2.508277 -2.527701 -0.626495
O 1.738267 1.832838 -1.969875
C 0.787297 -0.824916 -0.529151
C -1.015425 0.708777 0.252497
C 2.223874 -1.117329 -0.858002
C -1.984291 -0.316261 0.037107
C 0.356979 0.401181 -0.057162
C 3.106630 -1.104554 0.398886
C -1.509187 -1.592227 -0.454849
C -1.449823 1.977252 0.771064
C -0.182781 -1.846994 -0.719761
C -3.370494 -0.055763 0.308983
C 4.579679 -1.355081 0.052696
C -2.791598 2.191122 1.020404
C -3.751655 1.182308 0.787000
C -0.492212 3.088134 1.060750
C -4.415392 -1.098273 0.085777
C 5.460873 -1.337189 1.299723
C 1.964759 2.050535 -0.808174
C -2.139521 -3.834747 -1.134571
C 2.930142 3.010062 -0.199950
H 2.316676 -2.095775 -1.371190
H 2.588667 -0.371896 -1.600028
H 2.747429 -1.869094 1.114525
H 2.994805 -0.132850 0.922872
H 0.155218 -2.813410 -1.079600
H 4.685778 -2.328659 -0.465045
H 4.934153 -0.591821 -0.667299
H -3.134079 3.151135 1.407225
H -4.797849 1.399227 0.994490
H 0.365467 2.729542 1.652911
H -0.095876 3.516937 0.130186
H -0.955722 3.906357 1.625682
H -4.215925 -1.995622 0.695101
H -5.426703 -0.752905 0.328070
H -4.422088 -1.432913 -0.965182
H 5.162643 -2.112569 2.014985
H 5.404615 -0.374989 1.821018
H 6.511894 -1.513024 1.045054
H -1.704263 -3.745886 -2.134271
H -3.113021 -4.339669 -1.172699
H -1.463432 -4.337509 -0.437170
H 2.906865 2.994053 0.901188
H 2.716872 4.038688 -0.529531
H 3.959049 2.773978 -0.515013


%chk=000183629-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183629

0 1
O 1.358940 1.537015 0.163427
O -2.401088 -2.605706 -0.637436
O 1.433259 2.220097 -2.081381
C 0.826737 -0.696768 -0.573051
C -1.024003 0.785098 0.237720
C 2.297866 -0.960223 -0.849090
C -1.983148 -0.313442 0.059137
C 0.356755 0.528249 -0.095253
C 3.107635 -1.251918 0.444964
C -1.468851 -1.570224 -0.454394
C -1.493552 2.064248 0.740941
C -0.116069 -1.745969 -0.755904
C -3.382253 -0.119944 0.392044
C 4.602851 -1.520214 0.162215
C -2.852060 2.195682 1.048811
C -3.773961 1.132594 0.880790
C -0.619983 3.294163 0.950003
C -4.470787 -1.175464 0.256736
C 5.404654 -1.835366 1.443459
C 1.853298 2.311668 -0.911592
C -1.921419 -3.879047 -1.174762
C 2.945557 3.239201 -0.422494
H 2.387320 -1.828669 -1.530177
H 2.758865 -0.105383 -1.377356
H 2.664969 -2.126922 0.962306
H 3.006615 -0.392215 1.135633
H 0.252236 -2.700765 -1.140500
H 4.696680 -2.364921 -0.551170
H 5.042822 -0.636541 -0.344485
H -3.215832 3.156909 1.430429
H -4.826406 1.294619 1.140022
H 0.244427 3.092783 1.603428
H -0.229513 3.686504 -0.007440
H -1.223013 4.096425 1.409662
H -4.256014 -2.072618 0.861458
H -5.434802 -0.751068 0.588748
H -4.581062 -1.524782 -0.783562
H 5.005221 -2.735030 1.948357
H 5.348416 -0.996325 2.162355
H 6.471682 -2.018758 1.219523
H -1.483661 -3.751348 -2.183859
H -2.816123 -4.516457 -1.236178
H -1.175807 -4.346823 -0.502487
H 3.091293 3.151233 0.663371
H 2.686465 4.279432 -0.684734
H 3.888645 2.996289 -0.943134


