%chk=000188865.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188865

0 1
O -5.551706 0.453719 0.492338
O -5.495709 -2.119280 -0.875780
C -0.753618 0.276564 -0.059523
C 1.692347 0.106571 -0.093901
C 0.438582 -0.479641 -0.304760
C -0.658908 1.697693 0.025136
C 1.779359 1.543000 -0.027139
C 0.623832 2.325520 0.006267
C -2.057905 -0.324490 0.100662
C 2.937952 -0.667013 0.027456
C -3.196080 0.467326 0.094450
C 4.187183 -0.012309 -0.105111
C -1.862924 2.480315 0.088886
C 3.097179 2.163653 -0.104249
C 0.327785 -1.831594 -0.936590
C 0.694851 3.820981 0.014392
C -3.094414 1.888833 0.082548
C 4.229004 1.436756 -0.201429
C -2.227685 -1.762394 0.389355
C 2.951822 -2.044283 0.352313
C -4.558067 -0.137878 0.158702
C 5.391381 -0.751156 -0.064465
C -3.405007 -2.386478 0.243573
C 4.140324 -2.758504 0.413492
C -4.596405 -1.643726 -0.235712
C 5.368812 -2.116426 0.175064
H -1.784912 3.567146 0.135788
H 3.130406 3.258036 -0.107677
H 0.299160 -2.649823 -0.202307
H 1.181770 -2.028470 -1.607308
H -0.566486 -1.912700 -1.573474
H 1.727527 4.204092 -0.004727
H 0.225515 4.237807 0.917844
H 0.186596 4.249812 -0.861900
H -4.017618 2.474860 0.099201
H 5.204413 1.910163 -0.312984
H -1.352040 -2.293409 0.777514
H 2.019539 -2.556752 0.591523
H 6.339746 -0.235508 -0.210456
H -3.555608 -3.446172 0.448002
H 4.127701 -3.820426 0.654808
H 6.293804 -2.689818 0.199680


%chk=000188865-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000188865

0 1
O -5.643667 0.628613 -0.179614
O -5.913233 -2.171205 0.149795
C -0.753250 0.245961 -0.081550
C 1.723689 0.088358 -0.069784
C 0.450836 -0.527947 -0.286601
C -0.652541 1.699449 0.023977
C 1.805046 1.549539 0.034426
C 0.625465 2.344983 0.047698
C -2.085185 -0.347930 0.008848
C 2.986314 -0.684005 0.007368
C -3.238431 0.480350 -0.041177
C 4.253367 0.000977 -0.069100
C -1.858291 2.486156 0.021796
C 3.117588 2.174094 0.003914
C 0.357911 -1.887586 -0.985514
C 0.664820 3.866657 0.074500
C -3.112816 1.901133 -0.064568
C 4.278196 1.444890 -0.101851
C -2.293271 -1.775548 0.295101
C 3.038317 -2.091896 0.253100
C -4.616089 -0.094134 -0.034393
C 5.478707 -0.726857 -0.031448
C -3.526095 -2.380452 0.364866
C 4.253358 -2.795714 0.312376
C -4.768131 -1.630082 0.151366
C 5.488137 -2.118104 0.137718
H -1.784654 3.574717 0.072086
H 3.190042 3.262551 0.035697
H 0.308348 -2.772811 -0.325506
H 1.239155 -2.030499 -1.633435
H -0.539763 -1.915261 -1.625923
H 1.679785 4.272814 0.167400
H 0.085266 4.263399 0.928382
H 0.225834 4.295183 -0.846359
H -4.028541 2.499001 -0.102567
H 5.248622 1.951319 -0.160998
H -1.416579 -2.380941 0.528548
H 2.120191 -2.644025 0.451075
H 6.421050 -0.172044 -0.110672
H -3.624576 -3.444806 0.602985
H 4.243414 -3.873267 0.508870
H 6.433152 -2.670432 0.168671


