%chk=000114576.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000114576

0 1
O 2.456447 0.505449 0.153643
O 3.489881 -1.224372 -0.898109
C -1.243644 0.258429 0.199063
C -2.223374 1.249451 0.004932
C -1.624899 -1.093800 0.231095
C 0.156467 0.661911 0.375738
C -3.560900 0.887652 -0.164469
C -2.966447 -1.447157 0.063466
C -3.936032 -0.460128 -0.136133
C 1.187467 -0.040488 -0.108403
C 3.585014 -0.183732 -0.301564
C 4.784978 0.597436 0.091585
H -1.936818 2.299107 -0.019635
H -0.878525 -1.868293 0.396156
H 0.325194 1.592496 0.925105
H -4.315070 1.657853 -0.318912
H -3.256141 -2.496655 0.089613
H -4.979419 -0.738372 -0.267605
H 1.186666 -0.962769 -0.678967
H 4.529531 1.517002 0.645122
H 5.367916 0.892895 -0.796465
H 5.451606 -0.004114 0.731443


%chk=000114576-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000114576

0 1
O 2.502435 0.597220 0.076118
O 3.588892 -1.459310 -0.204856
C -1.275038 0.293056 0.039782
C -2.316754 1.255905 0.168763
C -1.642700 -1.073433 -0.137816
C 0.121948 0.756488 0.097663
C -3.674027 0.873538 0.123710
C -2.997861 -1.454562 -0.182474
C -4.022511 -0.485051 -0.051894
C 1.228979 -0.023923 -0.004869
C 3.655323 -0.224136 -0.037719
C 4.908272 0.609642 0.070876
H -2.053282 2.312056 0.305972
H -0.868753 -1.842143 -0.241992
H 0.278699 1.834260 0.238372
H -4.457436 1.632766 0.225733
H -3.260363 -2.509654 -0.319813
H -5.075052 -0.786635 -0.087320
H 1.257126 -1.108866 -0.146162
H 4.671358 1.670670 0.231129
H 5.504147 0.496899 -0.851796
H 5.526497 0.235014 0.905289


