%chk=000147819.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147819

0 1
 I    9.299100       1.370700     -9.6900001E-02
 O    3.617700      -1.168500      0.1561000    
 O    2.736800      0.9718000     -0.1772000    
 C   -4.963900      0.3964000     -0.1489000    
 C   -3.779100     -0.5592000      1.4000000E-03
 C   -6.295700     -0.3403000      4.4999998E-03
 C   -2.447000      0.1828000     -0.1186000    
 C   -7.480500      0.6211000     -0.1126000    
 C   -1.262300     -0.7677000      6.5700002E-02
 C   -8.810100     -0.1130000      7.5099997E-02
 C   7.0900001E-02 -2.9100001E-02 -8.8299997E-02
 C   -10.03090      0.7989000     -6.2700003E-02
 C    1.273700     -0.9599000      6.3000001E-02
 C   -11.35150      8.9299999E-02  0.1929000    
 C    2.599400     -0.2336000     -1.7200001E-02
 C    4.892300     -0.6002000      9.9399999E-02
 C    5.465200     -0.1433000       1.265500    
 C    5.526100     -0.5173000      -1.120500    
 C    6.737400      0.4259000       1.208900    
 C    6.798400      5.1800001E-02  -1.177100    
 C    7.404000      0.5235000     -1.2500000E-02
 H   -4.922900      0.8829000      -1.131000    
 H   -4.894300       1.187900      0.6072000    
 H   -3.836500      -1.340600     -0.7660000    
 H   -3.832800      -1.058900      0.9764000    
 H   -6.375900      -1.119800     -0.7628000    
 H   -6.326500     -0.8419000      0.9796000    
 H   -2.398300      0.9781000      0.6351000    
 H   -2.384200      0.6646000      -1.101900    
 H   -7.391500       1.412700      0.6412000    
 H   -7.464800       1.106600      -1.095800    
 H   -1.312200      -1.233100       1.057500    
 H   -1.319400      -1.574900     -0.6747000    
 H   -8.885800     -0.9237000     -0.6604000    
 H   -8.823800     -0.5832000       1.066300    
 H   0.1120000      0.4587000      -1.070400    
 H   0.1314000      0.7716000      0.6596000    
 H   -9.940300       1.635100      0.6410000    
 H   -10.04850       1.232100      -1.069800    
 H    1.224800      -1.462400       1.035900    
 H    1.252100      -1.717400     -0.7285000    
 H   -12.18690      0.7872000      7.9499997E-02
 H   -11.49520     -0.7333000     -0.5147000    
 H   -11.38450     -0.3205000       1.207400    
 H    4.946400     -0.2198000       2.215900    
 H    5.054800     -0.8848000      -2.026700    
 H    7.191000      0.7870000       2.128500    
 H    7.300000      0.1179000      -2.139300    


%chk=000147819-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000147819

0 1
I 9.969309 0.245328 0.264727
O 3.677938 -0.716025 -0.188013
O 2.733327 1.423424 0.115366
C -5.100028 0.427312 0.146013
C -3.839400 -0.404686 -0.180288
C -6.420103 -0.336360 -0.103009
C -2.520816 0.359916 0.072807
C -7.680285 0.495318 0.226577
C -1.259495 -0.474305 -0.244523
C -9.001155 -0.268473 -0.018170
C 0.051770 0.300571 0.010421
C -10.260900 0.564421 0.312127
C 1.298756 -0.553960 -0.288833
C -11.576024 -0.207110 0.068570
C 2.600764 0.201078 -0.091662
C 5.059531 -0.376958 -0.073367
C 5.580459 0.921790 0.137223
C 5.917154 -1.493976 -0.191737
C 6.982585 1.086014 0.229692
C 7.313700 -1.324330 -0.098088
C 7.838125 -0.029029 0.113494
H -5.093890 1.355895 -0.462531
H -5.059907 0.751890 1.207025
H -3.878462 -0.727958 -1.241770
H -3.847028 -1.333743 0.427698
H -6.461925 -0.659770 -1.164357
H -6.425805 -1.265625 0.504662
H -2.485602 0.687708 1.132764
H -2.510970 1.286195 -0.538689
H -7.637164 0.820661 1.287332
H -7.676057 1.423636 -0.382584
H -1.270762 -1.399564 0.369282
H -1.295944 -0.803099 -1.304546
H -9.046535 -0.594092 -1.078752
H -9.007359 -1.196567 0.591366
H 0.075947 1.216139 -0.610581
H 0.084951 0.643167 1.062915
H -10.213346 0.891606 1.371047
H -10.255396 1.490276 -0.298956
H 1.325620 -1.462996 0.341913
H 1.278981 -0.920398 -1.335578
H -12.460392 0.410972 0.310207
H -11.661332 -0.520410 -0.989239
H -11.621060 -1.120040 0.692210
H 4.917809 1.782164 0.229463
H 5.482766 -2.484494 -0.354885
H 7.391035 2.087131 0.392976
H 7.974821 -2.190446 -0.188622


