%chk=000183621.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183621

0 1
O -0.796161 1.851659 0.383534
O 2.090404 -2.831745 -0.397901
O -1.347737 2.288700 -1.786411
C -0.784258 -0.490678 -0.280956
C -2.269137 -0.473348 -0.510609
C -0.023008 -1.701855 -0.423539
C -3.039075 -0.233375 0.797032
C -0.108879 0.659813 0.081485
C 1.342616 -1.666314 -0.201560
C 1.308133 0.728392 0.288135
C 2.054312 -0.464904 0.132922
C -0.679983 -2.991400 -0.836512
C -4.552230 -0.173121 0.553087
C 1.982521 1.938505 0.636121
C 3.473596 -0.423911 0.287538
C -0.747958 -3.103504 -2.360144
C -5.321531 0.072797 1.849052
C 3.346203 1.947284 0.797035
C 4.101853 0.752987 0.612971
C 2.394363 -3.538598 0.832827
C -1.371529 2.614263 -0.629387
C -1.975521 3.814651 0.012052
H -2.513121 0.314296 -1.258677
H -2.613814 -1.418761 -0.978415
H -2.689401 0.707456 1.269454
H -2.801801 -1.034871 1.522559
H -0.105458 -3.853428 -0.432989
H -1.696206 -3.068908 -0.398270
H -4.785854 0.625134 -0.178330
H -4.897836 -1.117107 0.087538
H 1.385509 2.840684 0.768536
H 4.035670 -1.343759 0.119182
H -1.274930 -2.253004 -2.808478
H -1.259814 -4.020117 -2.669456
H 0.261032 -3.121536 -2.794925
H -5.026462 1.016204 2.321943
H -5.147067 -0.725973 2.579206
H -6.400892 0.119497 1.666335
H 3.871195 2.863846 1.060949
H 5.183532 0.794496 0.729378
H 2.999098 -4.378443 0.471873
H 1.470620 -3.887646 1.302228
H 2.965049 -2.900583 1.513130
H -3.066930 3.827426 -0.139279
H -1.573453 4.738188 -0.433728
H -1.789761 3.853214 1.097961


%chk=000183621-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183621

0 1
O -0.771358 2.034764 0.281478
O 2.014411 -2.855752 -0.306993
O -0.824135 2.570820 -2.005366
C -0.792103 -0.351537 -0.291406
C -2.298788 -0.280740 -0.488702
C -0.079243 -1.606688 -0.397121
C -3.083046 -0.427290 0.845978
C -0.070279 0.795557 0.055095
C 1.305386 -1.628288 -0.163989
C 1.342060 0.806832 0.283111
C 2.055326 -0.442238 0.147274
C -0.792614 -2.886802 -0.809431
C -4.612976 -0.361621 0.641996
C 2.070212 1.993141 0.623395
C 3.478725 -0.453395 0.311949
C -0.848048 -3.045532 -2.353819
C -5.399727 -0.486058 1.964430
C 3.454752 1.948854 0.800866
C 4.166268 0.718985 0.632663
C 2.258555 -3.558189 0.969686
C -1.086323 2.866863 -0.825961
C -1.778800 4.116344 -0.328693
H -2.575263 0.680561 -0.957736
H -2.629986 -1.067582 -1.189365
H -2.762711 0.373500 1.541024
H -2.814422 -1.388871 1.329452
H -0.253085 -3.756016 -0.396167
H -1.816415 -2.910681 -0.393633
H -4.873031 0.595123 0.143909
H -4.924893 -1.167177 -0.054005
H 1.523970 2.933104 0.745829
H 4.015917 -1.392766 0.149146
H -1.363301 -2.191933 -2.830701
H -1.382571 -3.971951 -2.633592
H 0.174540 -3.096557 -2.766135
H -5.128354 0.326222 2.664816
H -5.182033 -1.447192 2.467458
H -6.490708 -0.434589 1.792999
H 4.003513 2.861029 1.059492
H 5.255499 0.703003 0.748151
H 2.841380 -4.455639 0.710513
H 1.302785 -3.853438 1.446136
H 2.832079 -2.923895 1.672779
H -2.706750 3.846863 0.205394
H -2.015262 4.773346 -1.177703
H -1.133252 4.650109 0.389996


