%chk=000029843.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029843

0 1
 O    4.320200      -1.597200      -1.168500    
 O    4.291900       2.036100     -0.3813000    
 O    6.146200      0.4548000       1.152700    
 O   -4.686500       1.384900     -4.4399999E-02
 O   -4.291200      -1.499400     -0.5565000    
 O    1.704600       2.483200     -0.1173000    
 O   0.8884000      -2.792600      0.3764000    
 O   -1.646300      -2.458400      0.5648000    
 O  -0.7573000       2.966600      0.1003000    
 O   -6.292700      -1.917600      -1.595200    
 C    4.077300      0.6538000     -0.1827000    
 C    4.757800      0.1518000       1.117500    
 C    3.631200      -1.844100      7.9899997E-02
 C    4.542600     -0.1838000      -1.411100    
 C    2.596500      0.3121000     -2.6100000E-02
 C    4.568400      -1.379900       1.214100    
 C    2.376400      -1.006000      9.8099999E-02
 C    1.484900       1.283800     -9.3999999E-03
 C    1.032100      -1.582700      0.2585000    
 C   0.1154000      0.7389000      0.1380000    
 C  -0.1003000     -0.6337000      0.2685000    
 C    5.995600     -1.0300000E-02  -1.838500    
 C   -3.881400     -0.7911000      0.6242000    
 C   -2.494500     -0.2413000      0.4372000    
 C   -4.945000      0.2710000      0.8125000    
 C   -2.288600       1.140700      0.2758000    
 C   -1.401400      -1.121400      0.4213000    
 C   -3.481200       2.077100      0.3142000    
 C  -0.9749000       1.620100      0.1499000    
 C   -6.192500     -0.4252000      0.3134000    
 C   -5.639900      -1.352900     -0.7312000    
 C   -3.456000       3.262800     -0.6550000    
 H    4.318300      0.6487000       1.991200    
 H    3.433400      -2.917000      0.1515000    
 H    3.929000      9.1200002E-02  -2.280600    
 H    4.126200      -1.627900       2.187000    
 H    5.522200      -1.915500       1.146900    
 H    6.687800     -0.5525000      -1.190500    
 H    6.135700     -0.4447000      -2.835600    
 H    6.283900       1.043200      -1.888200    
 H   -3.903000      -1.495300       1.466100    
 H   -5.043600      0.6242000       1.844700    
 H    3.879300       2.288400      -1.225000    
 H   -3.596800       2.461400       1.335900    
 H    6.659900     -0.2968000      0.8192000    
 H   -6.661400      -1.028500       1.096100    
 H   -6.907300      0.2675000     -0.1379000    
 H   -2.767600       4.050700     -0.3409000    
 H   -3.184100       2.940300      -1.666500    
 H   -4.449800       3.721300     -0.7264000    
 H  -0.8300000      -2.975700      0.5096000    
 H   0.1090000       3.163700     -0.2859000    


%chk=000029843-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000029843

0 1
O 4.278306 -1.621544 -1.329382
O 4.413837 1.988892 -0.227617
O 6.160656 0.366740 1.236455
O -4.757567 1.510711 0.235833
O -4.510107 -1.332708 -0.676066
O 1.768125 2.492725 -0.062459
O 0.796839 -2.950006 0.328669
O -1.674800 -2.501941 0.497443
O -0.693463 2.957875 0.076869
O -6.669612 -1.498771 -1.525452
C 4.085675 0.576882 -0.147329
C 4.762024 -0.021760 1.151272
C 3.649380 -1.963059 -0.011202
C 4.589486 -0.161753 -1.451190
C 2.618168 0.230742 -0.024324
C 4.639538 -1.564867 1.116297
C 2.386163 -1.137213 0.077907
C 1.529961 1.193642 -0.004738
C 1.029821 -1.670052 0.201572
C 0.167751 0.693559 0.095029
C -0.073387 -0.710767 0.197410
C 6.072115 0.018488 -1.788470
C -3.896142 -0.781522 0.582869
C -2.513275 -0.246044 0.330227
C -4.897253 0.297996 1.051902
C -2.284793 1.132501 0.197613
C -1.409792 -1.175682 0.335009
C -3.426588 2.141816 0.176701
C -0.923487 1.610290 0.117303
C -6.246632 -0.294181 0.634880
C -5.913580 -1.087785 -0.637694
C -3.468839 2.988810 -1.111763
H 4.207677 0.409696 2.011782
H 3.452139 -3.042882 -0.052892
H 3.974542 0.218839 -2.291974
H 4.311911 -1.972471 2.087685
H 5.626294 -1.994570 0.873025
H 6.721206 -0.390150 -1.000206
H 6.285283 -0.497103 -2.741015
H 6.293125 1.093207 -1.912758
H -3.843002 -1.623449 1.297669
H -4.795199 0.520833 2.132114
H 3.558616 2.519160 -0.184410
H -3.305896 2.817421 1.053156
H 6.196459 1.338762 1.025678
H -6.649110 -0.984158 1.399139
H -6.999668 0.478886 0.422780
H -2.570558 3.618449 -1.192013
H -3.547304 2.333179 -1.995063
H -4.362962 3.633121 -1.075616
H -0.748497 -3.005526 0.454741
H 0.347317 3.093540 0.015407


