%chk=000179527.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179527

0 1
O 3.373520 1.281282 0.331600
C -2.223147 1.684957 -0.312649
C -3.002494 0.529602 0.321389
C -0.762895 1.662081 0.154634
C -2.411529 -0.814831 -0.117878
C -0.121980 0.303972 0.047791
C -0.908692 -0.863853 -0.037531
C 1.282611 0.182011 0.077361
C -0.287129 -2.121172 -0.082602
C 1.886684 -1.084858 0.036778
C 1.104401 -2.235391 -0.042650
C 2.177502 1.368833 0.143743
H -2.687376 2.654149 -0.051145
H -2.267275 1.610368 -1.417016
H -4.070594 0.583616 0.039858
H -2.971831 0.612933 1.425466
H -0.710625 1.986666 1.217938
H -0.185214 2.415469 -0.421007
H -2.712242 -1.028908 -1.166759
H -2.853498 -1.628084 0.493633
H -0.895928 -3.023226 -0.148473
H 2.978453 -1.150635 0.071151
H 1.573720 -3.216874 -0.072781
H 1.697260 2.352692 0.001347


%chk=000179527-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000179527

0 1
O 3.466073 1.283406 0.268305
C -2.269079 1.688140 -0.332442
C -3.017948 0.532183 0.360067
C -0.777378 1.696071 0.072512
C -2.438770 -0.813746 -0.120370
C -0.117938 0.313235 0.028304
C -0.913191 -0.866037 -0.059082
C 1.308618 0.174529 0.092044
C -0.277667 -2.133477 -0.099032
C 1.919447 -1.107311 0.043191
C 1.127701 -2.263954 -0.055241
C 2.204481 1.353175 0.229221
H -2.722203 2.663629 -0.075026
H -2.358689 1.569380 -1.431004
H -4.100685 0.577971 0.139559
H -2.903496 0.624537 1.458804
H -0.689587 2.101857 1.102146
H -0.232163 2.401344 -0.581858
H -2.761271 -0.987503 -1.168520
H -2.857035 -1.650384 0.471474
H -0.902567 -3.033597 -0.163558
H 3.012845 -1.156393 0.090767
H 1.590858 -3.255727 -0.088970
H 1.711345 2.349470 0.310905


