%chk=000112780.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000112780

0 1
 O   0.7114000     -5.6699999E-02  2.4100000E-02
 O   -5.114200     -7.7799998E-02 -1.8000000E-03
 O  -0.5438000      -1.996100     -6.2000002E-03
 O   -3.868500       1.867800      2.5900001E-02
 C    5.611600      0.3622000      8.2699999E-02
 C    6.974000     -0.3362000      4.4700000E-02
 C    4.429000     -0.6072000      2.2399999E-02
 C    8.156100      0.6354000      3.0700000E-02
 C    3.097700      0.1428000      3.9900001E-02
 C    9.485600     -0.1125000     -8.0600001E-02
 C    1.913700     -0.8137000      2.1800000E-02
 C    10.66250      0.8485000     -0.1336000    
 C   -7.509000     -0.2735000     -1.1000000E-02
 C   -8.839300      0.4743000     -2.1400001E-02
 C   -6.326000      0.6841000      4.3000001E-03
 C  -0.4464000     -0.7793000      8.8999998E-03
 C   -10.01720     -0.4850000     -8.0200002E-02
 C   -1.579900      0.1719000      1.5100000E-02
 C   -2.831900     -0.2999000      3.7000000E-03
 C   -3.965500      0.6509000      1.0500000E-02
 H    5.543800      0.9640000      0.9975000    
 H    5.545500       1.060600     -0.7610000    
 H    7.061000      -1.003100      0.9114000    
 H    7.020900     -0.9714000     -0.8488000    
 H    4.497600      -1.214600     -0.8879000    
 H    4.478400      -1.294800      0.8753000    
 H    8.144800       1.240900      0.9448000    
 H    8.051600       1.325000     -0.8157000    
 H    3.032400      0.8201000     -0.8208000    
 H    3.032600      0.7815000      0.9297000    
 H    9.490100     -0.7335000     -0.9841000    
 H    9.606700     -0.7853000      0.7764000    
 H    1.940100      -1.460300      0.9070000    
 H    1.949700      -1.437800     -0.8790000    
 H    10.58800       1.512900      -1.000400    
 H    11.60240      0.2930000     -0.2112000    
 H    10.70600       1.465400      0.7697000    
 H   -7.433500     -0.9267000     -0.8895000    
 H   -7.452200     -0.9371000      0.8609000    
 H   -8.924000       1.095900      0.8775000    
 H   -8.882100       1.146800     -0.8861000    
 H   -6.357100       1.307300      0.9057000    
 H   -6.351000       1.328800     -0.8821000    
 H   -10.02210      -1.153500      0.7867000    
 H   -10.95950      7.1699999E-02 -8.5199997E-02
 H   -9.979800      -1.097500     -0.9867000    
 H   -1.357600       1.233400      2.9100001E-02
 H   -3.053200      -1.361800     -1.0200000E-02


%chk=000112780-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000112780

0 1
O 0.730009 -0.019749 -0.007985
O -5.249378 -0.091172 -0.009874
O -0.509681 -2.003057 -0.040230
O -4.012288 1.893783 0.024551
C 5.723754 0.380013 -0.004473
C 7.085599 -0.350105 -0.015604
C 4.517748 -0.585820 -0.017815
C 8.295396 0.611080 -0.002949
C 3.158598 0.152920 -0.005984
C 9.656955 -0.120909 -0.013340
C 1.987527 -0.827863 -0.020425
C 10.860969 0.845416 -0.001187
C -7.676592 -0.269959 -0.010392
C -9.039323 0.463629 0.004670
C -6.508346 0.714435 0.004005
C -0.462067 -0.747412 -0.019996
C -10.232536 -0.515309 -0.010292
C -1.621012 0.180690 -0.004397
C -2.898514 -0.288938 -0.012648
C -4.058142 0.638108 0.003118
H 5.663369 1.030302 0.892927
H 5.662517 1.055749 -0.882820
H 7.146228 -1.026355 0.862858
H 7.145097 -1.001232 -0.912945
H 4.580620 -1.235172 -0.915861
H 4.581801 -1.261374 0.860582
H 8.238442 1.263153 0.893855
H 8.237876 1.287060 -0.881829
H 3.085521 0.821298 -0.885301
H 3.086316 0.794165 0.893363
H 9.712790 -0.772413 -0.909426
H 9.713653 -0.796150 0.864916
H 1.982254 -1.491106 0.864814
H 1.981920 -1.464291 -0.925157
H 10.843589 1.511015 -0.884934
H 11.821383 0.297887 -0.009552
H 10.845322 1.486746 0.900367
H -7.605028 -0.909727 -0.910837
H -7.601619 -0.939732 0.867666
H -9.101694 1.109429 0.904018
H -9.104770 1.140449 -0.871347
H -6.503710 1.350318 0.909182
H -6.505424 1.378364 -0.880789
H -10.207950 -1.184096 0.870327
H -11.196143 0.025430 0.002250
H -10.212729 -1.151224 -0.915055
H -1.416005 1.256375 0.014003
H -3.102902 -1.364750 -0.031127


