%chk=000074097.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000074097

0 1
 O    4.145000      0.1396000       2.676400    
 O   -6.888000     -5.4000001E-03   1.685800    
 C    2.496000      -1.043000       1.405300    
 C    2.192300      -1.986200      0.2408000    
 C    3.962100     -0.5956000       1.464300    
 C   -1.573800       2.116900     -0.9554000    
 C  -8.9800000E-02   2.283600     -0.6094000    
 C   0.7438000      -2.479800      0.2914000    
 C   -2.409300       1.568900      0.2044000    
 C   0.7394000       2.857500      -1.764000    
 C    4.446000      0.2486000      0.2744000    
 C   0.4311000      -3.400700     -0.8902000    
 C   -3.880900       1.346000     -0.1614000    
 C    2.220000       3.038800      -1.403000    
 C   -4.702600      0.7325000      0.9774000    
 C   -1.016000      -3.897700     -0.9046000    
 C    3.650800       1.508500      5.9900001E-02
 C    3.039300       1.814300      -1.094300    
 C   -6.166300      0.5458000      0.5937000    
 C   -1.338900      -4.792700      -2.091200    
 H    1.832900     -0.1696000       1.370400    
 H    2.247900      -1.549400       2.347800    
 H    2.873400      -2.844800      0.2747000    
 H    2.363900      -1.471700     -0.7112000    
 H    4.606300      -1.480500       1.535500    
 H   -1.665200       1.443100      -1.816300    
 H   -1.983800       3.085700      -1.266300    
 H   0.3144000       1.307200     -0.3162000    
 H   3.8000001E-03   2.941700      0.2633000    
 H   0.5668000      -3.016300       1.231200    
 H   6.1999999E-02  -1.620600      0.2748000    
 H   -2.348100       2.259700       1.054100    
 H   -1.976500      0.6173000      0.5375000    
 H   0.3261000       3.830200      -2.057200    
 H   0.6558000       2.198000      -2.636400    
 H    4.458100     -0.3653000     -0.6335000    
 H    5.483100      0.5541000      0.4631000    
 H    1.107200      -4.264300     -0.8659000    
 H   0.6333000      -2.866800      -1.827200    
 H   -3.938400      0.6883000      -1.037600    
 H   -4.325500       2.305100     -0.4545000    
 H    2.708500       3.544900      -2.245900    
 H    2.286100       3.739200     -0.5601000    
 H   -4.277300     -0.2356000       1.269800    
 H   -4.640500       1.368200       1.869300    
 H   -1.695200      -3.036800     -0.9173000    
 H   -1.219400      -4.449000      2.1199999E-02
 H    3.585400       2.204700      0.8919000    
 H    3.121900       1.107900      -1.918800    
 H    3.920600     -0.4499000       3.416400    
 H   -6.257400     -0.1336000     -0.2599000    
 H   -6.621000       1.506000      0.3295000    
 H  -0.7035000      -5.683900      -2.091600    
 H   -1.184400      -4.260100      -3.034900    
 H   -2.383100      -5.117700      -2.049700    
 H   -7.810800     -0.1062000       1.396400    


%chk=000074097-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000074097

0 1
O 4.759497 0.049823 2.426879
O -6.613518 -0.955165 1.057957
C 2.712584 -0.981192 1.456671
C 2.075698 -1.808118 0.317202
C 4.218806 -0.702165 1.267953
C -1.417749 2.032323 -1.054481
C 0.036986 2.264472 -0.588129
C 0.606340 -2.188478 0.608439
C -2.258301 1.217973 -0.045579
C 0.884851 3.054518 -1.609458
C 4.569353 0.160350 0.033182
C -0.074018 -2.951073 -0.550282
C -3.703752 0.951248 -0.522746
C 2.367786 3.236800 -1.180091
C -4.522081 0.113577 0.485777
C -1.546189 -3.319849 -0.255667
C 3.815611 1.472874 -0.022300
C 3.125345 1.926048 -1.101352
C -5.952958 -0.151738 0.012389
C -2.224952 -4.076820 -1.417387
H 2.184223 -0.012648 1.554753
H 2.570847 -1.524955 2.416912
H 2.666936 -2.732865 0.146342
H 2.119720 -1.226621 -0.625401
H 4.758299 -1.673187 1.180618
H -1.406952 1.503678 -2.031196
H -1.908699 3.011385 -1.237761
H 0.522028 1.286082 -0.392669
H 0.032916 2.806121 0.381197
H 0.561543 -2.805017 1.530734
H 0.029361 -1.264821 0.826223
H -2.285051 1.751211 0.927521
H -1.754391 0.247190 0.147212
H 0.429443 4.052680 -1.772831
H 0.854466 2.533089 -2.589517
H 4.388423 -0.426702 -0.887187
H 5.660034 0.353043 0.087365
H 0.497975 -3.877313 -0.769448
H -0.029568 -2.333843 -1.472282
H -3.672032 0.428625 -1.502196
H -4.213009 1.921465 -0.703134
H 2.863500 3.904923 -1.916006
H 2.413403 3.753194 -0.200732
H -4.023506 -0.860253 0.660938
H -4.564488 0.632097 1.463363
H -2.115810 -2.393251 -0.034331
H -1.590833 -3.935863 0.665572
H 3.855314 2.078917 0.894630
H 3.096633 1.303890 -2.012900
H 4.493785 -0.417616 3.259180
H -5.938293 -0.700511 -0.955353
H -6.487958 0.811653 -0.140926
H -1.696259 -5.023963 -1.636189
H -2.219869 -3.469974 -2.342799
H -3.276153 -4.323375 -1.179864
H -7.547718 -1.142772 0.787885


