%chk=000111330.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000111330

0 1
 O  -0.1515000      -2.697200      0.5017000    
 O   -4.855000     -0.8424000      -1.101800    
 O    5.376800      0.3073000      -1.336300    
 C   -1.937800      0.8550000     -0.2743000    
 C  -0.5886000      0.8618000      0.4533000    
 C   -2.736800     -0.4322000      2.1100000E-02
 C   0.2626000     -0.3440000     -7.3200002E-02
 C    1.699500     -0.3917000      0.5594000    
 C   -2.938000       1.979900     -2.8400000E-02
 C   -1.977900      -1.606500     -0.5761000    
 C   0.1511000       2.191000      0.2518000    
 C  -0.5760000      -1.646100      2.4599999E-02
 C   -4.034100     -4.6200000E-02 -0.6659000    
 C   -4.208400       1.461600     -0.7170000    
 C    1.530100       2.168400      0.9001000    
 C    2.330900      0.9979000      0.3868000    
 C   -3.074500     -0.6945000       1.500400    
 C    1.673100     -0.7346000       2.066200    
 C    2.545200      -1.459600     -0.1238000    
 C    3.505900       1.214200     -0.2258000    
 C    3.714100      -1.248200     -0.7369000    
 C    4.289700      0.1061000     -0.8057000    
 H   -1.715100      0.8907000      -1.355100    
 H  -0.7652000      0.7432000       1.528400    
 H   0.4011000     -0.2000000      -1.157800    
 H   -2.617400       2.931300     -0.4641000    
 H   -3.108300       2.144000       1.041100    
 H   -1.885600      -1.526900      -1.665400    
 H   -2.488900      -2.553100     -0.3660000    
 H  -0.4276000       3.014300      0.6866000    
 H   0.2516000       2.404800     -0.8205000    
 H   -4.245900       1.777600      -1.763400    
 H   -5.109900       1.771000     -0.1838000    
 H    1.435800       2.105700       1.990200    
 H    2.033200       3.120700      0.6922000    
 H   -3.717700      -1.578400       1.591400    
 H   -2.183700     -0.8791000       2.108100    
 H   -3.623200      0.1351000       1.958200    
 H    1.343200      -1.761900       2.252500    
 H    2.673200     -0.6407000       2.509200    
 H    1.008400     -7.8199998E-02   2.636000    
 H    2.194700      -2.487600     -9.2299998E-02
 H    3.917500       2.211900     -0.3367000    
 H    4.269900      -2.062700      -1.186700    


%chk=000111330-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000111330

0 1
O -0.136109 -2.674305 0.594251
O -4.873645 -0.916139 -1.232228
O 5.412156 0.210769 -1.485518
C -1.944244 0.895227 -0.255008
C -0.590206 0.905106 0.481038
C -2.729901 -0.432506 -0.048000
C 0.267864 -0.312960 -0.045394
C 1.720486 -0.373817 0.593279
C -2.996869 2.002236 0.024581
C -1.924360 -1.603541 -0.656647
C 0.168550 2.233755 0.269469
C -0.545540 -1.631767 0.017059
C -4.077543 -0.096578 -0.720221
C -4.278917 1.433940 -0.651061
C 1.587052 2.196890 0.895420
C 2.361276 1.002532 0.376002
C -3.069218 -0.744763 1.444386
C 1.663411 -0.682564 2.132441
C 2.523058 -1.493139 -0.053491
C 3.546417 1.160046 -0.290229
C 3.701694 -1.309627 -0.713358
C 4.304495 0.033331 -0.876748
H -1.713515 0.954064 -1.345173
H -0.766536 0.775284 1.567969
H 0.412893 -0.118955 -1.133872
H -2.705150 2.979183 -0.396057
H -3.147340 2.142543 1.111147
H -1.804478 -1.444496 -1.747021
H -2.418921 -2.576578 -0.501496
H -0.410084 3.066857 0.711776
H 0.255905 2.435681 -0.817891
H -4.395208 1.807608 -1.686917
H -5.219942 1.675459 -0.125410
H 1.487915 2.144181 1.998701
H 2.129361 3.131200 0.665228
H -3.713556 -1.640376 1.490910
H -2.159112 -0.958881 2.032546
H -3.605628 0.086056 1.935367
H 1.257501 -1.692660 2.299365
H 2.680552 -0.634151 2.558453
H 1.031729 0.042940 2.674314
H 2.110097 -2.499316 0.079386
H 3.986204 2.155960 -0.428271
H 4.257905 -2.152028 -1.140775


