%chk=000195077.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195077

0 1
O 0.655261 -0.289321 0.238065
O -0.123138 1.247269 -1.803764
O -1.233813 -1.508188 0.457413
C 3.619128 -1.169268 -0.777338
C 4.117072 -0.177528 0.283234
C 3.406316 -2.580120 -0.213299
C 4.129172 1.264847 -0.244346
C 2.128663 -2.698590 0.629823
C 2.712123 1.831991 -0.420595
C -3.036177 1.995661 -0.953170
C -3.517536 0.923529 0.030842
C -1.673871 2.589939 -0.565132
C 0.845035 -2.605939 -0.210561
C -0.086889 0.922788 0.584519
C -4.903782 0.389989 -0.354481
C -0.580507 1.558799 -0.731987
C 2.081774 2.190853 0.887490
C 0.869284 1.814014 1.312289
C -5.361063 -0.745115 0.574786
C -0.050284 -1.471562 0.196898
C -4.570591 -2.033575 0.362326
H 2.663260 -0.788688 -1.203157
H 4.334087 -1.209102 -1.619868
H 5.131238 -0.460040 0.620485
H 3.464464 -0.235796 1.178467
H 3.377031 -3.309708 -1.045734
H 4.277550 -2.873587 0.405096
H 4.658267 1.304352 -1.216801
H 4.716107 1.905156 0.441261
H 2.136071 -3.659085 1.180110
H 2.133909 -1.903912 1.406444
H 2.088407 1.088633 -0.978425
H 2.741704 2.732633 -1.068515
H -2.974916 1.569669 -1.976366
H -3.779490 2.815189 -1.012137
H -3.544946 1.328803 1.059161
H -2.798569 0.072776 0.058987
H -1.705877 2.994831 0.463815
H -1.451508 3.456645 -1.223674
H 1.091436 -2.483928 -1.290678
H 0.265778 -3.551871 -0.143039
H -0.957373 0.628059 1.223201
H -5.645494 1.210515 -0.325759
H -4.889941 0.028382 -1.401192
H 2.703065 2.828591 1.526207
H 0.501089 2.139056 2.287452
H -5.273342 -0.424195 1.631121
H -6.438672 -0.939488 0.407090
H -4.880010 -2.813674 1.064247
H -4.698855 -2.425314 -0.651888
H -3.489447 -1.872076 0.507077


%chk=000195077-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000195077

0 1
O 0.858159 -0.362540 0.571035
O -0.355198 0.845455 -1.591592
O -1.148393 -1.546065 0.572340
C 3.669637 -1.168779 -0.872480
C 4.167342 -0.119914 0.151081
C 3.546404 -2.598999 -0.289490
C 4.190289 1.322751 -0.413337
C 2.365970 -2.806625 0.695717
C 2.775602 1.964402 -0.562299
C -3.049320 2.018213 -0.817250
C -3.677839 0.894536 0.038150
C -1.649608 2.465231 -0.306417
C 0.958155 -2.715361 0.027741
C 0.096343 0.887537 0.825350
C -5.062657 0.452490 -0.486465
C -0.615721 1.355543 -0.474076
C 2.186710 2.380871 0.768066
C 1.048094 1.937939 1.371974
C -5.701064 -0.697909 0.332453
C 0.095398 -1.528255 0.415973
C -4.948460 -2.043334 0.207648
H 2.690325 -0.853072 -1.281468
H 4.375264 -1.190425 -1.728905
H 5.190815 -0.398731 0.476921
H 3.525685 -0.143796 1.052307
H 3.439232 -3.325470 -1.121642
H 4.492511 -2.858793 0.229133
H 4.680383 1.316177 -1.408168
H 4.811367 1.970940 0.238476
H 2.466486 -3.808343 1.155234
H 2.437855 -2.074772 1.519841
H 2.104619 1.274341 -1.098229
H 2.875131 2.875124 -1.189711
H -2.942635 1.673603 -1.864066
H -3.718866 2.901141 -0.832228
H -3.784500 1.244756 1.087654
H -2.994634 0.025022 0.062981
H -1.707304 2.786030 0.750775
H -1.305679 3.333859 -0.901869
H 1.073196 -2.663392 -1.074613
H 0.352565 -3.613926 0.234698
H -0.698721 0.670435 1.564790
H -5.746911 1.327063 -0.486199
H -4.964309 0.131385 -1.544807
H 2.776758 3.130632 1.320502
H 0.776394 2.353718 2.350663
H -5.750656 -0.398849 1.400144
H -6.749351 -0.837771 -0.000708
H -5.456556 -2.836400 0.787569
H -4.909090 -2.371264 -0.848861
H -3.908020 -1.973108 0.571665


