%chk=000185648.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185648

0 1
O 1.025055 -1.894312 -0.882199
O -1.888143 -2.010007 -1.559973
O -1.100953 -2.213839 2.041120
O 0.353954 -0.048709 2.743813
O -3.721799 2.523888 0.903008
O -4.639217 1.884740 -1.192019
O 4.937279 0.756466 -1.592075
C -0.584179 -1.377850 0.995909
C 0.008937 -2.421658 0.025156
C -1.668684 -0.536286 0.387973
C -1.048916 -3.000306 -0.911007
C 0.524614 -0.481910 1.624696
C -2.249149 -0.905101 -0.832575
C 1.688750 -0.221071 0.782285
C 1.866989 -0.913633 -0.444484
C -2.127554 0.628237 1.065726
C -3.269587 -0.150378 -1.483701
C -3.113503 1.353675 0.451243
C 2.624701 0.755738 1.179612
C -3.675723 0.973831 -0.813701
C 2.930364 -0.654572 -1.325789
C 3.692590 1.036957 0.341614
C 3.813606 0.325868 -0.901577
C -4.697830 2.891608 -0.119459
C 4.826129 1.946935 0.382485
C 5.529692 1.754779 -0.762925
H 0.519353 -3.230542 0.607219
H -0.596854 -3.507225 -1.789070
H -1.728209 -3.679266 -0.356188
H -1.705243 0.925267 2.028025
H -1.392775 -1.654252 2.807993
H -3.676007 -0.471138 -2.438939
H 2.489224 1.275345 2.133176
H 3.038032 -1.189585 -2.264976
H -5.699096 2.839785 0.328370
H -4.394345 3.854038 -0.552422
H 5.032338 2.628506 1.187232
H 6.413562 2.155480 -1.209476


%chk=000185648-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185648

0 1
O 0.838901 -1.787776 -1.008757
O -2.002320 -2.219498 -1.482076
O -1.211378 -2.360853 2.062495
O 0.439347 -0.373929 2.906215
O -3.482451 2.683605 0.745093
O -4.539339 1.947702 -1.286848
O 4.753344 1.033517 -1.644176
C -0.603541 -1.505834 1.030273
C -0.011250 -2.483649 -0.007272
C -1.630571 -0.588578 0.368848
C -1.127666 -3.174176 -0.779157
C 0.535218 -0.682593 1.676247
C -2.281133 -1.008835 -0.825568
C 1.649978 -0.290518 0.804482
C 1.742444 -0.838567 -0.525032
C -1.991477 0.656945 0.968308
C -3.274457 -0.214270 -1.462636
C -2.966305 1.422556 0.340764
C 2.611173 0.649908 1.262014
C -3.591325 0.995090 -0.852797
C 2.758670 -0.439591 -1.418933
C 3.634832 1.059357 0.391345
C 3.668577 0.502555 -0.930238
C -4.502950 3.040062 -0.272366
C 4.763016 1.977952 0.472104
C 5.400186 1.935283 -0.746134
H 0.607098 -3.234393 0.522894
H -0.725707 -3.824297 -1.571103
H -1.729882 -3.762897 -0.061749
H -1.514656 0.993010 1.892880
H -1.084946 -1.876668 2.927721
H -3.753734 -0.561920 -2.379335
H 2.511218 1.038557 2.280194
H 2.818241 -0.861466 -2.423833
H -5.492095 3.106285 0.213037
H -4.205153 3.978009 -0.771802
H 5.054353 2.585059 1.326525
H 6.273144 2.434357 -1.157525


