%chk=000114865.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000114865

0 1
 O   -4.975200      -1.477400      3.2699998E-02
 O   0.2970000       3.387100       2.136400    
 O    5.711500      -1.175200       1.626500    
 O    3.803100     -0.8392000       2.807100    
 C   -4.104200      0.4528000       1.026900    
 C   -3.042400     -0.3960000     -0.9653000    
 C   -2.693300      0.1939000      0.4311000    
 C   -4.583100     -0.4554000     -0.9119000    
 C   -4.932000      0.8371000     -0.1918000    
 C   -4.741000     -0.9023000       1.338600    
 C   -2.381300      -1.743800      -1.222200    
 C   -1.872000       1.436500      0.3340000    
 C  -0.8782000      -1.766300      -1.259300    
 C  -0.6770000       1.589500      0.9231000    
 C   0.1458000       2.843300      0.8237000    
 C  -5.6400001E-02  -2.428700     -0.4309000    
 C    1.553100       2.591200      0.2652000    
 C    1.439800      -2.403800     -0.5487000    
 C    1.545300       1.915300      -1.109100    
 C    2.147200      -1.853700      0.6974000    
 C    2.947600       1.590700      -1.634100    
 C    2.947200      0.9803000      -3.036200    
 C    3.673400      -1.806200      0.5760000    
 C    4.360400      0.6677000      -3.504900    
 C    4.364700      -1.237400       1.795900    
 H   -4.123700       1.154700       1.863500    
 H   -2.745600      0.3010000      -1.761800    
 H   -2.172100     -0.5422000       1.057000    
 H   -5.064900     -0.6098000      -1.879700    
 H   -4.593900       1.739200     -0.7091000    
 H   -5.998900      0.9200000      4.1700002E-02
 H   -5.708000     -0.7970000       1.841400    
 H   -4.100600      -1.568100       1.924100    
 H   -2.719800      -2.474600     -0.4765000    
 H   -2.737200      -2.126100      -2.187900    
 H   -2.272600       2.259800     -0.2527000    
 H  -0.4340000      -1.174100      -2.057800    
 H  -0.2667000      0.7768000       1.517900    
 H  -0.3542000       3.600400      0.2083000    
 H  -0.4797000      -3.029300      0.3698000    
 H    2.094100       3.544500      0.2101000    
 H    2.122300       1.973800      0.9736000    
 H    1.746500      -1.814500      -1.421300    
 H    1.783900      -3.429200     -0.7310000    
 H    1.032200       2.568900      -1.825300    
 H   0.9774000      0.9793000      -1.070200    
 H  -0.5916000       3.592900       2.474300    
 H    1.775600     -0.8419000      0.9053000    
 H    1.874600      -2.461700       1.569900    
 H    3.542100       2.513000      -1.648100    
 H    3.444500      0.9114000     -0.9341000    
 H    2.476500       1.673700      -3.742500    
 H    2.352900      5.9599999E-02  -3.040400    
 H    3.956400      -1.200600     -0.2901000    
 H    4.052500      -2.823400      0.4242000    
 H    4.338800      0.2328000      -4.509000    
 H    4.845900     -4.8799999E-02  -2.834600    
 H    4.971900       1.575000      -3.540300    
 H    6.160600     -0.7889000       2.408400    


%chk=000114865-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000114865

0 1
O -5.185857 -1.531787 0.433414
O -0.079070 3.897692 1.713990
O 5.753733 -1.250837 0.759927
O 3.986611 -0.782046 2.190729
C -4.174843 0.528438 1.147848
C -3.275255 -0.590954 -0.847372
C -2.800664 0.191577 0.451244
C -4.824304 -0.599910 -0.681597
C -5.112782 0.788001 -0.067872
C -4.767203 -0.800213 1.678920
C -2.667087 -2.005908 -1.013888
C -1.978586 1.426344 0.159111
C -1.175217 -1.991959 -1.269511
C -0.805266 1.747837 0.766900
C -0.036329 3.024254 0.506616
C -0.241791 -2.639408 -0.524022
C 1.461389 2.803694 0.235325
C 1.248208 -2.623567 -0.795984
C 1.753550 2.060285 -1.085800
C 2.059039 -1.962981 0.349685
C 3.265720 1.826991 -1.302713
C 3.593733 1.052606 -2.599374
C 3.573501 -2.006889 0.071841
C 5.105859 0.790224 -2.776232
C 4.395197 -1.291550 1.124911
H -4.113233 1.321412 1.909253
H -3.029131 0.006536 -1.750692
H -2.206383 -0.479263 1.101204
H -5.401740 -0.921153 -1.561024
H -4.786156 1.628983 -0.702896
H -6.171935 0.919404 0.209718
H -5.660816 -0.650000 2.313778
H -4.024955 -1.414770 2.221922
H -2.906846 -2.612936 -0.121745
H -3.179735 -2.495357 -1.870101
H -2.384638 2.121076 -0.596356
H -0.837807 -1.408229 -2.142751
H -0.373771 1.077865 1.526896
H -0.499466 3.561544 -0.351937
H -0.570309 -3.220530 0.353121
H 1.951270 3.796870 0.225804
H 1.891548 2.244113 1.089769
H 1.446093 -2.085907 -1.745319
H 1.613620 -3.663602 -0.936420
H 1.345029 2.639072 -1.940835
H 1.225596 1.084334 -1.089808
H -1.019042 3.940028 2.027740
H 1.732068 -0.913793 0.473265
H 1.841918 -2.468838 1.309572
H 3.791058 2.804640 -1.318916
H 3.675891 1.274544 -0.431152
H 3.209057 1.619729 -3.471479
H 3.044344 0.087224 -2.595667
H 3.811695 -1.553363 -0.909686
H 3.936795 -3.052478 0.011461
H 5.317030 0.238202 -3.710686
H 5.510329 0.197959 -1.932819
H 5.668012 1.742509 -2.812981
H 6.267526 -0.779158 1.470968


