%chk=000158130.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158130

0 1
 I   -7.157600       1.566200     -0.7893000    
 O  -0.6069000     -0.6420000      1.1500000E-02
 O   0.8917000      -2.206100      0.8142000    
 C    2.189500      0.8871000      0.4031000    
 C    3.034000     -0.3216000      0.1854000    
 C    1.651200     -0.2802000     -0.3710000    
 C    1.700300       1.123800       1.792500    
 C    2.461400       2.144100     -0.3543000    
 C    4.161900     -0.2651000     -0.7640000    
 C   0.6339000      -1.165500      0.2245000    
 C    5.423300      0.1399000     -0.5217000    
 C    6.463400      0.1369000      -1.607300    
 C    5.903700      0.6208000      0.8182000    
 C   -1.695600      -1.405600      0.5405000    
 C   -2.984100     -0.7037000      0.2268000    
 C   -3.497400      0.2269000       1.122900    
 C   -3.653200     -0.9912000     -0.9577000    
 C   -4.695600      0.8788000      0.8309000    
 C   -4.851300     -0.3392000      -1.249700    
 C   -5.372600      0.5957000     -0.3554000    
 H    3.219900     -0.9748000       1.032300    
 H    1.540900     -0.1533000      -1.444900    
 H    1.605900      0.2034000       2.379100    
 H    2.392200       1.778300       2.334400    
 H   0.7190000       1.610600       1.777000    
 H    3.299100       2.690400      9.2900001E-02
 H    2.698900       1.969600      -1.409400    
 H    1.583800       2.799800     -0.3312000    
 H    3.932600     -0.6060000      -1.772800    
 H    6.849100       1.149400      -1.764800    
 H    7.298600     -0.5145000      -1.330300    
 H    6.066600     -0.2198000      -2.563600    
 H    6.722700     -1.2300000E-02   1.175100    
 H    6.269800       1.649800      0.7401000    
 H    5.120200      0.6076000       1.581500    
 H   -1.577800      -1.514800       1.625900    
 H   -1.693100      -2.409800      9.8300003E-02
 H   -2.976900      0.4565000       2.048700    
 H   -3.254900      -1.716200      -1.662200    
 H   -5.083700       1.604200       1.541500    
 H   -5.362400     -0.5744000      -2.179900    


%chk=000158130-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000158130

0 1
I -7.282714 -0.021737 -2.152299
O -0.541705 -0.207622 0.221614
O 0.878992 -1.025420 1.884777
C 2.489864 1.693551 1.338684
C 3.137551 0.546558 0.548862
C 1.592467 0.808113 0.414403
C 2.388639 1.546039 2.855571
C 2.686491 3.137300 0.875952
C 4.029201 0.741867 -0.622337
C 0.668415 -0.217055 0.943460
C 5.022301 -0.099223 -1.041934
C 5.862938 0.245619 -2.260286
C 5.387126 -1.412279 -0.372649
C -1.543214 -1.222874 0.647329
C -2.853772 -0.925384 -0.047760
C -3.255356 0.401849 -0.334827
C -3.726541 -1.989989 -0.378824
C -4.507417 0.666073 -0.933914
C -4.985790 -1.743023 -0.971430
C -5.366232 -0.411544 -1.242718
H 3.341489 -0.336435 1.165443
H 1.250956 1.283544 -0.509275
H 2.206167 0.501335 3.156569
H 3.329475 1.888441 3.326433
H 1.564316 2.166755 3.255654
H 3.663994 3.521577 1.223725
H 2.653468 3.243624 -0.222144
H 1.895846 3.784530 1.298622
H 3.866651 1.660064 -1.205780
H 6.937394 0.314282 -1.996264
H 5.778979 -0.541560 -3.036153
H 5.559517 1.206039 -2.711918
H 5.306906 -2.248832 -1.094940
H 6.440564 -1.394409 -0.028626
H 4.752240 -1.656354 0.493798
H -1.636017 -1.171888 1.749509
H -1.164289 -2.229387 0.392546
H -2.577437 1.229524 -0.105501
H -3.430086 -3.026775 -0.178436
H -4.803274 1.695521 -1.155469
H -5.647600 -2.576714 -1.221670


