%chk=000112894.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000112894

0 1
 O   -4.322700      0.2080000      0.2060000    
 O   -3.165900      -1.705800     -0.3684000    
 C    3.123700      0.4976000      0.1183000    
 C    1.878300     -0.3852000     -1.7000000E-03
 C    4.400600     -0.3163000     -0.1059000    
 C   0.5701000      0.3730000      0.2443000    
 C    5.683000      0.5098000      3.2900002E-02
 C  -0.6791000     -0.4928000      5.1800001E-02
 C    6.995800     -0.2557000     -0.1585000    
 C   -1.969800      0.3015000      0.2365000    
 C    8.240300      0.6080000      4.7300000E-02
 C   -6.733100      0.4718000      0.2805000    
 C   -3.200400     -0.5340000     -1.5300000E-02
 C    9.512800     -0.2180000     -6.4199999E-02
 C   -5.563100     -0.4745000     -2.3000001E-03
 C   -8.061600     -0.2704000      0.1532000    
 C   -6.708800       1.683000     -0.6544000    
 H    3.071500       1.311500     -0.6145000    
 H    3.151600      0.9578000       1.113200    
 H    1.948200      -1.214500      0.7131000    
 H    1.851200     -0.8320000      -1.003500    
 H    4.433900      -1.143900      0.6135000    
 H    4.374000     -0.7672000      -1.105600    
 H   0.5214000       1.228700     -0.4406000    
 H   0.5751000      0.7817000       1.262200    
 H    5.650000       1.334800     -0.6901000    
 H    5.691200      0.9727000       1.028100    
 H  -0.6607000     -0.9324000     -0.9536000    
 H  -0.6559000      -1.331100      0.7593000    
 H    7.014500     -0.6894000      -1.165800    
 H    7.018200      -1.095600      0.5471000    
 H   -1.987600       1.145900     -0.4616000    
 H   -2.019600      0.6864000       1.261100    
 H    8.205700       1.080400       1.035700    
 H    8.260600       1.412400     -0.6969000    
 H   -6.636300      0.8484000       1.306800    
 H    10.39120      0.4183000      8.2400002E-02
 H    9.592000     -0.6846000      -1.051200    
 H    9.535800      -1.008300      0.6929000    
 H   -5.607300     -0.8361000      -1.037100    
 H   -5.610900      -1.335400      0.6756000    
 H   -8.205700     -0.6579000     -0.8612000    
 H   -8.102800      -1.115800      0.8481000    
 H   -8.901700      0.3929000      0.3847000    
 H   -5.788500       2.262300     -0.5281000    
 H   -6.774600       1.375300      -1.703700    
 H   -7.550900       2.351200     -0.4447000    


%chk=000112894-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000112894

0 1
O -4.383522 0.220967 0.212279
O -3.269309 -1.785795 -0.185335
C 3.159911 0.461341 0.169400
C 1.890125 -0.376139 -0.101630
C 4.469636 -0.304654 -0.123765
C 0.577834 0.383858 0.195089
C 5.742847 0.525615 0.154808
C -0.681095 -0.472357 -0.062214
C 7.051188 -0.244968 -0.132727
C -1.983915 0.294559 0.235342
C 8.325835 0.583188 0.148041
C -6.808858 0.534861 0.253577
C -3.231132 -0.557248 0.056756
C 9.627448 -0.197910 -0.134979
C -5.686787 -0.499725 0.093123
C -8.171162 -0.198637 0.298621
C -6.771455 1.590257 -0.874776
H 3.130063 1.384859 -0.446328
H 3.160360 0.794416 1.228678
H 1.923005 -1.300094 0.512756
H 1.889057 -0.708590 -1.160773
H 4.495739 -1.230745 0.488125
H 4.471716 -0.633996 -1.184088
H 0.539222 1.302789 -0.427193
H 0.584805 0.723973 1.252331
H 5.719886 1.450192 -0.459685
H 5.739184 0.857467 1.214484
H -0.690662 -0.819105 -1.113781
H -0.647376 -1.387709 0.558898
H 7.057174 -0.576379 -1.192487
H 7.074526 -1.169958 0.481079
H -2.078539 1.190163 -0.408582
H -1.982270 0.676207 1.276360
H 8.316651 0.917998 1.205638
H 8.304649 1.504822 -0.469102
H -6.651981 1.049781 1.222801
H 10.523272 0.416842 0.070357
H 9.673730 -0.520358 -1.192494
H 9.688878 -1.105964 0.494325
H -5.725268 -0.999498 -0.893751
H -5.725194 -1.278254 0.877807
H -8.354955 -0.750580 -0.643253
H -8.218908 -0.922831 1.133408
H -8.996081 0.524579 0.429136
H -5.790686 2.095101 -0.910046
H -6.951659 1.116608 -1.859545
H -7.552226 2.357552 -0.720987


