%chk=000188010.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188010

0 1
O 0.694143 0.544839 -1.678510
O 1.786753 2.068202 -0.381622
O -1.574067 -0.574723 -1.724412
O -0.373276 2.763139 -0.056884
O -3.400494 0.607371 -2.351208
O 0.038588 3.984455 1.807909
C 0.093695 0.408843 -0.355955
C 0.755591 -0.750240 0.349800
C -1.422113 0.266752 -0.538350
C 0.578570 1.748775 0.316653
C 2.014938 1.054622 -1.410254
C 2.149679 -0.943651 0.086381
C 0.059851 -1.587989 1.198324
C 2.849468 -0.050474 -0.797456
C -2.088592 -0.452345 0.610206
C -1.376067 -1.344205 1.442412
C 2.835423 -2.015177 0.700531
C 0.763846 -2.676142 1.809764
C 4.186814 -0.228600 -1.039219
C 2.099579 -2.882463 1.570427
C -3.456783 -0.234993 0.817951
C -2.055498 -1.976081 2.497178
C 4.231196 -2.178311 0.426182
C 4.881703 -1.309313 -0.415128
C -4.120050 -0.876419 1.866257
C -3.415844 -1.742386 2.708583
C -2.610006 -0.277126 -2.586987
C -0.514698 3.895498 0.742913
C -2.541176 -1.208911 -3.743375
C -1.438582 4.831595 0.053296
H -1.887455 1.268140 -0.745426
H 0.787701 1.764159 1.399738
H 2.383927 1.555693 -2.314444
H 0.213147 -3.348226 2.469541
H 4.739367 0.440090 -1.698525
H 2.624725 -3.714426 2.040319
H -4.006010 0.433762 0.147799
H -1.518414 -2.654912 3.160333
H 4.763898 -3.002527 0.899565
H 5.944929 -1.428053 -0.623063
H -5.183032 -0.700995 2.026127
H -3.929359 -2.238216 3.531756
H -3.462738 -1.805968 -3.822820
H -1.689733 -1.907346 -3.665934
H -2.427418 -0.649631 -4.685975
H -1.898382 4.384965 -0.845814
H -0.899181 5.736445 -0.273572
H -2.247958 5.156903 0.725483


%chk=000188010-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000188010

0 1
O 0.796702 0.749016 -1.728756
O 1.822328 2.089771 -0.095203
O -1.467442 -0.764173 -1.793778
O -0.457309 2.830818 -0.028176
O -3.367168 0.345057 -2.581961
O -0.210653 3.845507 2.072476
C 0.118526 0.457486 -0.430099
C 0.781551 -0.736712 0.248753
C -1.373443 0.240933 -0.674971
C 0.479905 1.759531 0.363251
C 2.113534 1.185995 -1.275511
C 2.172623 -0.949337 0.005951
C 0.048300 -1.585268 1.095132
C 2.909970 -0.002155 -0.785369
C -2.066801 -0.334835 0.545138
C -1.375322 -1.266008 1.380945
C 2.842693 -2.083875 0.582886
C 0.725775 -2.717221 1.668914
C 4.266578 -0.200717 -1.030904
C 2.073572 -2.967263 1.410646
C -3.411292 0.004054 0.808780
C -2.074559 -1.832845 2.478100
C 4.239729 -2.262946 0.312558
C 4.933174 -1.344545 -0.481624
C -4.093503 -0.570966 1.903594
C -3.418649 -1.491892 2.737705
C -2.522630 -0.573848 -2.693478
C -0.686013 3.860543 0.920699
C -2.489969 -1.622985 -3.782794
C -1.559464 4.928617 0.307359
H -1.852431 1.171347 -1.017767
H 0.491739 1.668202 1.460673
H 2.584576 1.785069 -2.066814
H 0.167240 -3.414011 2.301782
H 4.831753 0.519453 -1.633788
H 2.562326 -3.845422 1.848472
H -3.922270 0.703375 0.138297
H -1.563904 -2.526573 3.153771
H 4.761042 -3.125684 0.743357
H 6.000072 -1.490496 -0.681407
H -5.135667 -0.302406 2.105814
H -3.936244 -1.937406 3.594341
H -3.419875 -2.217048 -3.746399
H -1.620370 -2.285707 -3.671355
H -2.456182 -1.123477 -4.766190
H -2.420720 4.475455 -0.210916
H -0.978631 5.486484 -0.448883
H -1.902591 5.623508 1.087246


