%chk=000086558.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000086558

0 1
O -2.039316 -2.180395 0.210353
C 1.155316 -0.457546 -0.219727
C 0.674366 0.968238 0.195993
C 0.220046 -1.508562 0.420032
C 2.602308 -0.744144 0.260660
C -0.796003 1.164680 -0.121440
C 1.090581 -0.587080 -1.753107
C 0.881793 1.272361 1.685763
C -1.677873 0.142715 -0.121114
C -1.250912 -1.256272 0.163288
C 3.648191 0.235174 -0.264165
C -1.213779 2.568533 -0.418166
C -3.132856 0.320397 -0.410085
H 1.275082 1.704067 -0.397405
H 0.371718 -1.546871 1.518529
H 0.476920 -2.526926 0.063505
H 2.881266 -1.771900 -0.048349
H 2.631728 -0.752754 1.367962
H 1.424565 -1.576250 -2.084263
H 0.071616 -0.448796 -2.132478
H 1.726521 0.153175 -2.249052
H 1.941551 1.231961 1.961097
H 0.515761 2.274270 1.939082
H 0.344391 0.561103 2.323824
H 3.688643 0.237161 -1.359912
H 3.448041 1.262564 0.059750
H 4.648361 -0.032174 0.097018
H -1.549513 2.664027 -1.462055
H -0.411785 3.300658 -0.264712
H -2.059676 2.877143 0.214835
H -3.671761 -0.642592 -0.364698
H -3.299144 0.736691 -1.411646
H -3.610449 0.988339 0.318384


%chk=000086558-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000086558

0 1
O -2.088315 -2.243847 0.174133
C 1.162870 -0.461849 -0.240422
C 0.664949 0.966138 0.175659
C 0.216642 -1.510793 0.404546
C 2.615644 -0.752060 0.252193
C -0.826936 1.164085 -0.111061
C 1.106471 -0.602685 -1.787443
C 0.933667 1.324973 1.668967
C -1.736209 0.127014 -0.095385
C -1.272335 -1.268218 0.152579
C 3.715037 0.206559 -0.257192
C -1.245365 2.589277 -0.406203
C -3.223720 0.312992 -0.346473
H 1.216552 1.710140 -0.438136
H 0.364426 -1.526780 1.505072
H 0.452942 -2.531409 0.050037
H 2.871860 -1.786286 -0.057857
H 2.626426 -0.758815 1.360518
H 1.474322 -1.598701 -2.097572
H 0.077290 -0.489197 -2.170041
H 1.733252 0.160545 -2.283730
H 2.015388 1.375822 1.882244
H 0.500128 2.310867 1.916502
H 0.478149 0.584958 2.350650
H 3.804009 0.183265 -1.357820
H 3.523138 1.253379 0.043202
H 4.698134 -0.080332 0.159210
H -1.021109 2.837693 -1.464445
H -0.677225 3.310211 0.210737
H -2.321387 2.763288 -0.246225
H -3.723970 -0.667286 -0.288074
H -3.422561 0.746441 -1.344285
H -3.686468 0.981608 0.403817


