%chk=000118788.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000118788

0 1
O 4.469565 -0.805161 0.462591
O 2.587263 -1.924447 0.004981
C -2.138853 -0.286029 -0.434309
C -0.970695 0.604396 0.011230
C -3.453936 0.146406 0.227451
C 0.340431 0.173652 -0.657852
C -4.624039 -0.744234 -0.213757
C 1.549301 0.959307 -0.234497
C -5.936188 -0.318427 0.441180
C 2.860494 0.402836 -0.754436
C 1.541014 2.063806 0.512871
C 3.208736 -0.892699 -0.086207
H -1.922440 -1.343465 -0.185130
H -2.242663 -0.251704 -1.535794
H -1.190375 1.662203 -0.231626
H -0.861694 0.556864 1.112890
H -3.673197 1.202706 -0.020092
H -3.351881 0.111146 1.329276
H 0.232838 0.239953 -1.761255
H 0.520614 -0.908824 -0.446491
H -4.728350 -0.710512 -1.315869
H -4.407308 -1.801274 0.036924
H -6.200775 0.713039 0.182419
H -5.879449 -0.377469 1.534091
H -6.764789 -0.959916 0.120995
H 2.797463 0.237574 -1.854288
H 3.688345 1.138210 -0.618093
H 0.642701 2.520780 0.900051
H 2.431720 2.600478 0.802612
H 4.751446 -1.642492 0.919233


%chk=000118788-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000118788

0 1
O 4.579499 -0.630935 0.557774
O 2.818918 -1.971457 -0.141552
C -2.170634 -0.290044 -0.418568
C -0.971850 0.577129 0.028421
C -3.507658 0.142810 0.223829
C 0.352975 0.128161 -0.619628
C -4.708088 -0.724105 -0.220233
C 1.594467 0.921673 -0.239645
C -6.040129 -0.286553 0.426394
C 2.911676 0.410728 -0.843557
C 1.600044 2.013442 0.569429
C 3.384499 -0.855166 -0.143325
H -1.969422 -1.352161 -0.166363
H -2.265133 -0.246298 -1.524116
H -1.174303 1.637723 -0.226276
H -0.878302 0.529685 1.132581
H -3.710927 1.204769 -0.029015
H -3.415212 0.099243 1.329396
H 0.247382 0.163269 -1.726641
H 0.539625 -0.940702 -0.385876
H -4.799744 -0.680353 -1.324865
H -4.503493 -1.784681 0.032182
H -6.283087 0.760634 0.163824
H -5.984534 -0.350158 1.529702
H -6.881291 -0.922151 0.093349
H 2.755493 0.158057 -1.910178
H 3.700804 1.173947 -0.770050
H 0.680434 2.405164 1.015063
H 2.528321 2.544367 0.810670
H 4.844971 -1.469334 1.026374


