%chk=000235261.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235261

0 1
O -0.343415 2.796033 0.658563
O 0.347728 -2.781275 -0.658519
O 0.030053 2.218900 -1.472931
O -0.025693 -2.204308 1.473028
O 5.980780 -0.347473 0.142340
O -5.976713 0.361796 -0.141770
C 0.401431 0.576422 0.344234
C -0.397309 -0.561752 -0.344023
C 1.890038 0.355064 0.236044
C -1.885930 -0.340490 -0.235738
C 0.029626 1.897031 -0.308236
C -0.025338 -1.882357 0.308358
C 2.609915 -0.044366 1.379487
C -2.605881 0.059041 -1.379103
C 2.560142 0.523366 -0.982852
C -2.555973 -0.508973 0.983169
C 3.977503 -0.270435 1.308642
C -3.973478 0.285033 -1.308164
C 3.936095 0.303572 -1.079492
C -3.931937 -0.289265 1.079899
C 4.631919 -0.091754 0.070162
C -4.627831 0.106163 -0.069677
C 6.766393 -0.196059 -1.065398
C -6.762226 0.210416 1.066035
H 0.099734 0.622032 1.430188
H -0.095677 -0.607322 -1.430000
H 2.088819 -0.186752 2.329110
H -2.084835 0.201589 -2.328726
H 2.004339 0.839714 -1.871581
H -2.000117 -0.825390 1.871841
H 4.552502 -0.580690 2.178709
H -4.548526 0.595385 -2.178165
H 4.439026 0.441323 -2.030772
H -4.434823 -0.427170 2.031180
H -0.596325 3.684120 0.285605
H 0.600724 -3.669357 -0.285607
H 6.425627 -0.898681 -1.831111
H 7.772413 -0.457549 -0.711138
H 6.730990 0.839888 -1.414427
H -6.421307 0.912941 1.831767
H -6.726915 -0.825562 1.414984
H -7.768247 0.472055 0.711886


%chk=000235261-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235261

0 1
O -0.195340 2.884556 0.746296
O 0.199536 -2.865131 -0.754200
O -0.057337 2.186592 -1.461034
O 0.065899 -2.169074 1.453998
O 6.104089 -0.327102 0.168248
O -6.101408 0.338081 -0.161768
C 0.402586 0.574350 0.366588
C -0.399060 -0.555644 -0.371254
C 1.921358 0.368581 0.275522
C -1.917946 -0.351874 -0.277293
C 0.026992 1.921113 -0.239901
C -0.020763 -1.902520 0.233262
C 2.657979 -0.002236 1.430805
C -2.657155 0.019059 -1.430884
C 2.611929 0.510372 -0.952001
C -2.606111 -0.495815 0.951326
C 4.044252 -0.226100 1.363560
C -4.043602 0.240991 -1.360910
C 4.004195 0.288719 -1.036330
C -3.998516 -0.276086 1.038405
C 4.723105 -0.081301 0.127669
C -4.720022 0.094101 -0.123929
C 6.852972 -0.192125 -1.083360
C -6.847831 0.200857 1.091065
H 0.104702 0.579110 1.427793
H -0.102892 -0.559078 -1.432938
H 2.136195 -0.130062 2.385566
H -2.137263 0.148555 -2.386446
H 2.063888 0.812671 -1.852056
H -2.056031 -0.798276 1.850081
H 4.619711 -0.514726 2.248132
H -4.621043 0.529716 -2.244157
H 4.509672 0.409193 -1.999043
H -4.502090 -0.398174 2.001912
H -0.403206 3.756848 0.311596
H 0.408667 -3.737704 -0.320672
H 6.491707 -0.906980 -1.848274
H 7.895136 -0.425758 -0.820759
H 6.790866 0.839530 -1.481312
H -6.486151 0.915458 1.856019
H -6.783578 -0.831099 1.487892
H -7.890792 0.433314 0.830587


