%chk=000183624.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183624

0 1
O -2.557318 -1.480408 -0.387896
O 2.368020 0.875782 0.652413
O 2.696230 1.883215 -1.366946
C -2.542153 1.412172 -0.004660
C -1.299366 0.541134 0.038900
C -0.013654 1.159348 0.248513
C -3.421817 1.127938 -1.239410
C -1.346510 -0.833578 -0.114479
C -0.174991 -1.670177 -0.116980
C 1.106840 0.353504 0.300785
C 1.083371 -1.066216 0.111745
C -3.336325 1.269664 1.299904
C 0.125650 2.648518 0.419684
C -2.733446 1.540603 -2.536984
C -0.233294 -3.075923 -0.365148
C 2.260748 -1.873987 0.139197
C 0.468372 3.020752 1.860275
C 0.912126 -3.833366 -0.345839
C 2.174032 -3.226586 -0.081407
C -3.165945 -2.107708 0.769996
C 3.106799 1.610589 -0.270224
C 4.403838 1.955445 0.375121
H -2.217123 2.491810 -0.079049
H -4.383275 1.665191 -1.136208
H -3.680081 0.047152 -1.279421
H -2.707344 1.488957 2.169768
H -4.188787 1.956146 1.322657
H -3.730257 0.248950 1.424803
H 0.903835 3.028744 -0.278422
H -0.812407 3.168513 0.109182
H -3.353804 1.298740 -3.406872
H -2.523390 2.614626 -2.567867
H -1.777203 1.015603 -2.664197
H -1.204913 -3.518701 -0.590241
H 3.214905 -1.387198 0.339212
H -0.322118 2.708204 2.552574
H 0.601748 4.101648 1.970979
H 1.396104 2.529251 2.185143
H 0.875838 -4.904366 -0.537724
H 3.063984 -3.853457 -0.064480
H -2.451019 -2.737910 1.303953
H -3.967504 -2.702697 0.319046
H -3.572157 -1.320152 1.424292
H 4.482981 1.563838 1.402468
H 4.537064 3.048001 0.421285
H 5.246918 1.549291 -0.206140


%chk=000183624-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183624

0 1
O -2.637727 -1.481065 -0.095497
O 2.441123 0.917746 0.588455
O 2.786311 1.440552 -1.675333
C -2.563303 1.419916 0.091438
C -1.299232 0.548805 0.170322
C 0.010226 1.163348 0.317072
C -3.246657 1.316822 -1.308567
C -1.366755 -0.852251 0.040416
C -0.193086 -1.682884 -0.044983
C 1.144354 0.342718 0.325124
C 1.101698 -1.073830 0.139018
C -3.595298 1.152887 1.221302
C 0.174295 2.665987 0.514799
C -2.359664 1.812229 -2.471118
C -0.259360 -3.084110 -0.343837
C 2.276758 -1.893385 0.101191
C -0.114785 3.110085 1.973527
C 0.901464 -3.858177 -0.399527
C 2.178379 -3.262429 -0.153631
C -3.061075 -2.276930 1.077320
C 3.201148 1.420366 -0.502003
C 4.543113 1.917387 -0.009859
H -2.247569 2.472335 0.206193
H -4.178017 1.918643 -1.273879
H -3.545991 0.266952 -1.478627
H -3.113902 1.112718 2.216259
H -4.345275 1.965937 1.239138
H -4.132217 0.206072 1.050130
H 1.204193 2.961888 0.257631
H -0.481447 3.216549 -0.182851
H -2.888319 1.720220 -3.437679
H -2.081718 2.876384 -2.342074
H -1.425477 1.226293 -2.541965
H -1.231992 -3.528169 -0.575231
H 3.252397 -1.429400 0.273399
H -1.147912 2.861947 2.276995
H 0.020932 4.201677 2.083465
H 0.573167 2.604262 2.674171
H 0.838204 -4.924045 -0.644258
H 3.081521 -3.881551 -0.184583
H -2.320113 -3.057397 1.330330
H -4.015148 -2.743831 0.786807
H -3.211745 -1.622817 1.956740
H 4.652917 1.770626 1.073828
H 4.647487 2.989046 -0.253618
H 5.347298 1.382772 -0.544646


