%chk=000188029.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188029

0 1
O 3.144762 -0.632620 -1.472721
O 1.211903 0.547611 -0.903470
O 3.609978 2.581135 1.097806
O 4.154032 -0.098194 2.053582
O 4.089460 2.257003 -2.097980
O 3.291275 -3.418688 -0.226194
O -6.861651 0.608129 1.871563
C 3.938049 1.493195 0.226637
C 3.440118 0.168493 0.850792
C 3.192542 1.812348 -1.088480
C 3.567728 -1.003548 -0.140257
C 2.419867 0.586863 -1.641734
C 2.722562 -2.214193 0.289805
C 0.218242 -0.411920 -1.369049
C -1.043189 -0.009468 -0.611368
C -2.187964 -0.994694 -0.880873
C -3.425496 -0.585976 -0.129348
C -3.663048 -1.077368 1.161782
C -4.346376 0.301254 -0.717500
C -4.807311 -0.701244 1.870371
C -5.493643 0.692000 -0.034350
C -5.707169 0.180369 1.257594
H 5.040366 1.498085 0.076133
H 2.384241 0.294325 1.211981
H 2.511090 2.692214 -0.938504
H 4.629079 -1.310349 -0.296233
H 2.264236 0.611436 -2.741495
H 1.672841 -2.112234 -0.061505
H 2.749840 -2.369075 1.387333
H 0.589324 -1.421677 -1.093409
H 0.109905 -0.332135 -2.462383
H 3.795556 2.330280 2.035265
H 5.093120 -0.323989 1.878256
H 4.749191 1.561487 -2.319467
H -0.826787 0.048833 0.475451
H -1.341457 1.021093 -0.894364
H -2.399632 -1.047001 -1.968788
H -1.884991 -2.022496 -0.593636
H 3.277144 -3.403155 -1.208830
H -2.950749 -1.760350 1.624434
H -4.160462 0.689306 -1.719189
H -4.988117 -1.084462 2.868837
H -6.218871 1.375659 -0.469922
H -6.964437 0.226216 2.776525


%chk=000188029-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000188029

0 1
O 3.218185 -0.787427 -1.321011
O 1.260232 0.598396 -0.901102
O 4.229266 2.731518 0.770128
O 4.381632 0.227450 2.150357
O 4.259005 2.010234 -2.420061
O 2.612971 -3.240958 -0.088390
O -7.012562 0.315354 2.029502
C 4.202337 1.477803 0.026650
C 3.605145 0.352401 0.896687
C 3.394624 1.698949 -1.276210
C 3.572818 -0.982014 0.127181
C 2.509650 0.476894 -1.618079
C 2.607448 -2.020094 0.719546
C 0.174494 -0.263115 -1.426189
C -1.068470 -0.017299 -0.569068
C -2.271674 -0.880131 -1.042523
C -3.533235 -0.605730 -0.236303
C -3.893173 -1.418072 0.866839
C -4.366218 0.502190 -0.547104
C -5.041945 -1.139348 1.641082
C -5.515735 0.796604 0.211564
C -5.852010 -0.027348 1.310297
H 5.240373 1.169424 -0.253036
H 2.600225 0.644521 1.240902
H 2.757116 2.586587 -1.151995
H 4.592077 -1.420502 0.084635
H 2.349143 0.423919 -2.712640
H 1.589804 -1.583128 0.787468
H 2.937683 -2.316483 1.728983
H 0.485311 -1.327617 -1.382918
H -0.013943 0.003938 -2.488365
H 4.522029 2.517372 1.696434
H 5.281325 -0.138608 1.939646
H 4.864260 1.239296 -2.577231
H -0.838449 -0.246448 0.488653
H -1.334642 1.055075 -0.613025
H -2.457645 -0.673214 -2.115683
H -1.999643 -1.951224 -0.966971
H 2.558839 -2.952781 -1.038478
H -3.271772 -2.284034 1.126210
H -4.114407 1.143450 -1.401061
H -5.303794 -1.785217 2.489706
H -6.160399 1.647122 -0.029051
H -7.161175 -0.315207 2.777124


