%chk=000072434.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072434

0 1
 O   0.5771000       4.052300       1.122400    
 O  -0.9856000       2.425400       1.494500    
 O    3.013100      -3.314100     -0.8383000    
 O    4.938700      -2.255000      0.1478000    
 O   -2.354700      -1.768700       2.181500    
 O   -4.340900     -0.1180000      -1.851800    
 O   -4.554500      -1.543400      0.5127000    
 C   0.3941000       2.401400     -0.5477000    
 C    1.791900       3.004700     -0.5633000    
 C   0.3630000      0.8992000     -0.9092000    
 C    2.784100       2.185900      0.2778000    
 C    1.616300      9.5700003E-02 -0.5733000    
 C    1.537100       4.344100      9.7300000E-02
 C    2.769800      0.7187000     -4.1299999E-02
 C  -9.7300000E-02   2.895900      0.8046000    
 C  -0.9595000      0.2424000     -0.5263000    
 C    1.665800      -1.279100     -0.8906000    
 C    3.921500     -3.8800001E-02  0.2434000    
 C    2.815700      -1.987600     -0.6099000    
 C    3.912500      -1.384500     -5.1500000E-02
 C   -2.059200      0.3620000      -1.370100    
 C   -1.057200     -0.4715000      0.6641000    
 C   -2.266600      -1.072000       1.014000    
 C   -3.268700     -0.2383000      -1.020200    
 C   -3.372500     -0.9555000      0.1718000    
 C    4.360100      -3.478800     -0.3499000    
 C   -1.178000      -1.839300       2.984200    
 C   -5.202800      0.9987000      -1.640700    
 C   -4.763300      -2.881800      6.7699999E-02
 H  -0.2424000       2.931300      -1.273500    
 H    2.175400       3.118800      -1.583500    
 H   0.3897000      0.8879000      -2.012300    
 H    2.580000       2.290800       1.351500    
 H    3.789400       2.593600      0.1088000    
 H    2.433800       4.780000      0.5479000    
 H    1.095400       5.072300     -0.5917000    
 H   0.8208000      -1.782500      -1.350400    
 H    4.802200      0.4247000      0.6770000    
 H   -1.984200      0.9206000      -2.299600    
 H  -0.1807000     -0.5121000       1.300100    
 H    4.986000      -3.856400      -1.166600    
 H    4.352500      -4.218300      0.4591000    
 H  -0.3661000      -2.362700       2.467400    
 H   -1.427000      -2.436300       3.867900    
 H  -0.8757000     -0.8504000       3.345400    
 H   -5.640200      0.9639000     -0.6379000    
 H   -6.010400      0.9520000      -2.376300    
 H   -4.655800       1.936600      -1.780100    
 H   -4.748100      -2.931100      -1.025600    
 H   -5.745600      -3.209800      0.4183000    
 H   -4.002500      -3.549600      0.4842000    


%chk=000072434-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000072434

0 1
O 1.238784 3.766296 1.833060
O 0.083810 1.846405 2.404515
O 2.895407 -3.377753 -0.757664
O 5.031298 -2.344941 -0.387932
O -2.870039 -1.464977 2.150725
O -4.011937 -0.284782 -2.452041
O -4.721340 -1.509341 0.039924
C 0.549729 2.435067 -0.035080
C 1.858885 3.183689 -0.402415
C 0.419537 1.058605 -0.742100
C 3.107704 2.309479 -0.107838
C 1.677275 0.194626 -0.551396
C 1.788695 4.373894 0.576446
C 2.944725 0.807196 -0.338000
C 0.557412 2.557477 1.506558
C -0.920883 0.356990 -0.499457
C 1.581361 -1.219960 -0.720539
C 4.129881 0.013117 -0.275839
C 2.753193 -1.967417 -0.658605
C 4.008142 -1.363351 -0.441268
C -1.892021 0.360363 -1.523517
C -1.223677 -0.274365 0.730898
C -2.482148 -0.877162 0.934933
C -3.147458 -0.268391 -1.340626
C -3.454053 -0.914649 -0.112782
C 4.361934 -3.615910 -0.779170
C -1.947805 -1.316313 3.286964
C -5.385119 0.224699 -2.243159
C -4.732049 -2.944082 0.402734
H -0.314303 3.053400 -0.363336
H 1.843626 3.513806 -1.455792
H 0.408780 1.330699 -1.821123
H 3.394905 2.456725 0.954218
H 3.959522 2.686759 -0.705535
H 2.764636 4.810917 0.840626
H 1.094335 5.165625 0.239733
H 0.613355 -1.697004 -0.889090
H 5.106370 0.474715 -0.100070
H -1.697984 0.830425 -2.493758
H -0.487213 -0.250876 1.534793
H 4.669937 -3.881793 -1.808145
H 4.610877 -4.392887 -0.039983
H -1.013856 -1.886706 3.120669
H -2.490648 -1.732631 4.148320
H -1.704358 -0.252550 3.464430
H -5.902201 -0.351116 -1.458664
H -5.886050 0.100549 -3.215644
H -5.355409 1.297903 -1.970251
H -4.194873 -3.536222 -0.362379
H -5.796011 -3.226319 0.418394
H -4.276178 -3.094629 1.395056


