%chk=000181715.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181715

0 1
O 1.797553 0.130406 0.253452
O 1.578075 -1.945188 -0.442653
O 4.945956 0.740277 -2.255657
O 4.537122 -1.973299 -1.105280
O 4.259178 2.798486 -0.288880
O 1.602112 2.901291 1.974813
O 0.655323 2.779106 -0.059014
O 1.245928 -2.915334 1.580064
O -5.606520 2.580746 0.509149
C 4.402953 0.433975 -0.969391
C 3.610728 -0.893881 -1.073724
C 3.508092 1.649038 -0.637589
C 2.585083 -1.075191 0.063161
C 2.565060 1.306109 0.546503
C 1.488386 2.380014 0.711216
C -0.367913 -3.246822 -0.301469
C 0.844941 -2.744025 0.464108
C -1.512821 -2.286883 -0.038757
C -0.609389 -4.702364 0.085877
C -1.326887 -0.940831 -0.278699
C -2.782786 -2.752207 0.419743
C -2.387506 -0.008108 -0.083392
C -3.655076 -0.475593 0.362328
C -3.820711 -1.876521 0.611952
C -2.204191 1.390134 -0.328764
C -4.719970 0.447749 0.548821
C -4.498476 1.789435 0.292156
C -3.232861 2.280216 -0.149247
C -5.495844 3.999247 0.245066
H 5.244509 0.337149 -0.246601
H 3.102529 -0.975299 -2.072787
H 2.940214 1.983026 -1.546446
H 2.987282 -1.418289 1.036615
H 3.122493 1.165628 1.502810
H 5.450757 -0.037142 -2.600808
H 4.950444 -2.130817 -0.228968
H 5.005389 2.589920 0.312193
H -0.139811 -3.200360 -1.406516
H 0.253886 -5.333848 -0.161132
H -0.795045 -4.813933 1.164307
H -1.474848 -5.115727 -0.448542
H -0.355136 -0.557525 -0.616379
H -2.925541 -3.813756 0.617932
H 0.933746 3.617917 2.161755
H -4.790532 -2.229925 0.959648
H -1.219753 1.741594 -0.660505
H -5.694221 0.105536 0.886917
H -3.086844 3.339011 -0.339577
H -6.507496 4.350426 0.488230
H -5.264882 4.174438 -0.809544
H -4.754581 4.453595 0.908205


%chk=000181715-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000181715

0 1
O 3.023151 0.947517 -0.998539
O 1.471342 -0.651230 -0.806262
O 6.223901 -1.206717 0.657603
O 3.588777 -1.983637 1.322354
O 6.532197 1.598452 0.057880
O 4.141954 4.029245 -1.240394
O 4.827591 2.486651 -2.841024
O 1.129424 -2.543740 0.528137
O -7.019046 1.396237 1.999775
C 5.068507 -0.314786 0.573473
C 3.801739 -1.101301 0.183116
C 5.425503 0.780446 -0.432094
C 2.640321 -0.100580 -0.062067
C 4.213600 1.719755 -0.573468
C 4.436762 2.742539 -1.686714
C -0.500257 -1.949562 -1.232637
C 0.769993 -1.774058 -0.403711
C -1.699147 -1.414303 -0.432169
C -0.679674 -3.437397 -1.630256
C -2.494040 -0.387009 -0.948419
C -2.033175 -1.986426 0.844562
C -3.643743 0.093747 -0.239761
C -3.980800 -0.490561 1.044552
C -3.139976 -1.535905 1.560216
C -4.478003 1.136092 -0.754824
C -5.123012 -0.015665 1.754261
C -5.919099 1.006270 1.219646
C -5.594860 1.590758 -0.049531
C -7.887852 2.457613 1.484697
H 4.879018 0.152887 1.565307
H 3.978933 -1.665052 -0.757953
H 5.663585 0.328848 -1.416651
H 2.266920 0.313833 0.900526
H 4.027264 2.244950 0.383211
H 5.974480 -1.952313 1.263427
H 2.693039 -2.431195 1.210190
H 7.279643 0.983757 0.275423
H -0.382407 -1.329963 -2.137856
H 0.164861 -3.788056 -2.250299
H -0.739819 -4.079366 -0.735641
H -1.611815 -3.553527 -2.208744
H -2.242945 0.066635 -1.915918
H -1.397822 -2.777424 1.258599
H 4.309901 4.683344 -1.972741
H -3.382444 -1.977738 2.533825
H -4.230651 1.584218 -1.724549
H -5.392901 -0.443923 2.724983
H -6.213314 2.389168 -0.469874
H -8.663321 2.587853 2.253654
H -8.360541 2.165050 0.526965
H -7.333643 3.407173 1.352418


