%chk=000187166.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187166

0 1
O 4.844091 -1.630773 -0.000053
C 0.270994 -0.042344 -0.000028
C 1.691718 0.222586 -0.000021
C -0.647328 1.020256 -0.000013
C -0.197054 -1.407553 -0.000064
C -2.062578 0.741784 -0.000041
C -2.510139 -0.606161 -0.000160
C 2.615469 -0.863191 -0.000033
C 2.162173 1.562573 -0.000003
C -1.551294 -1.664249 -0.000141
C -0.139494 2.373747 0.000004
C 0.789022 -2.483530 -0.000030
C 1.195722 2.633539 0.000010
C 2.115157 -2.226983 -0.000017
C -3.928322 -0.874001 -0.000269
C 3.984734 -0.557905 -0.000043
C -3.028764 1.796434 0.000047
C 3.554604 1.813502 0.000004
C 4.464796 0.769700 -0.000012
C -4.825851 0.171663 -0.000161
C -4.371763 1.518169 0.000012
C -4.427336 -2.283866 -0.000486
H -1.905783 -2.694271 -0.000203
H -0.865312 3.189501 0.000020
H 0.409853 -3.504523 0.000001
H 1.568068 3.657746 0.000024
H 2.862832 -3.023492 0.000003
H -2.677093 2.828864 0.000152
H 3.910629 2.844658 0.000034
H 5.533053 0.964584 0.000007
H -5.898382 -0.014387 -0.000199
H -5.109049 2.319508 0.000114
H -4.079039 -2.831031 -0.888620
H -4.078919 -2.831384 0.887380
H -5.523797 -2.342731 -0.000417
H 5.791379 -1.345638 0.000105


%chk=000187166-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187166

0 1
O 4.904317 -1.680532 -0.000039
C 0.285858 -0.025259 -0.000072
C 1.704304 0.231085 -0.000024
C -0.654173 1.060090 -0.000042
C -0.189527 -1.397726 -0.000152
C -2.082542 0.778679 -0.000088
C -2.537255 -0.601733 -0.000168
C 2.635510 -0.869075 -0.000053
C 2.189300 1.588727 0.000055
C -1.571299 -1.652443 -0.000198
C -0.132957 2.406865 0.000034
C 0.779238 -2.476288 -0.000181
C 1.230229 2.661020 0.000081
C 2.136785 -2.227897 -0.000132
C -3.956938 -0.897018 -0.000216
C 4.027361 -0.580721 -0.000003
C -3.067459 1.819338 -0.000058
C 3.593848 1.824443 0.000103
C 4.503103 0.754619 0.000073
C -4.871437 0.161520 -0.000184
C -4.430453 1.519184 -0.000105
C -4.453078 -2.331758 -0.000304
H -1.910301 -2.693642 -0.000261
H -0.823270 3.254334 0.000054
H 0.404777 -3.506825 -0.000241
H 1.597821 3.694091 0.000138
H 2.864055 -3.044112 -0.000153
H -2.759460 2.868391 0.000005
H 3.964663 2.855392 0.000162
H 5.583664 0.950301 0.000108
H -5.946413 -0.054430 -0.000220
H -5.170478 2.327199 -0.000080
H -4.100509 -2.887228 -0.890531
H -4.100483 -2.887354 0.889834
H -5.555664 -2.362037 -0.000289
H 5.845858 -1.378402 0.000049


