%chk=000123790.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000123790

0 1
 O    4.785000      1.5699999E-02  0.9442000    
 O   5.4000001E-02  0.3748000       2.915500    
 O   -5.538000       1.664700      -1.058600    
 C    2.333400     -0.2274000      0.7865000    
 C    1.465500     -0.8702000     -0.3234000    
 C   3.7500001E-02  -1.178000      0.1508000    
 C  -0.6393000      0.1814000      0.5288000    
 C    1.667800       1.094400       1.234400    
 C    3.698200     -0.1092000      3.5900000E-02
 C   0.1756000      0.9357000       1.618000    
 C    2.349100      -2.003000     -0.8427000    
 C    3.787100      -1.451300     -0.7393000    
 C   -2.179000     -1.7700000E-02  0.7715000    
 C    2.545400      -1.142500       2.031300    
 C  -0.7730000      -1.937900     -0.8693000    
 C   -2.765600     -0.5375000     -0.5612000    
 C   -2.045500      -1.650500      -1.203300    
 C   -2.525900      -1.037300       1.883500    
 C   -2.834000       1.284800       1.202400    
 C    3.755900       1.023700     -0.9094000    
 C   -3.847500      2.1299999E-02  -1.133700    
 C   -2.757600      -2.497700      -2.225700    
 C   -3.895800       1.844300      0.6163000    
 C   -4.515100       1.208900     -0.5585000    
 C    3.802600       1.944700      -1.678600    
 C    3.859500       3.066000      -2.615300    
 H    1.366600     -0.1586000      -1.159100    
 H   8.5699998E-02  -1.824300       1.033800    
 H  -0.5602000      0.8300000     -0.3619000    
 H    1.704200       1.828000      0.4209000    
 H    2.229700       1.526000       2.071800    
 H  -0.2246000       1.953400       1.698400    
 H    2.105300      -2.270100      -1.876200    
 H    2.243100      -2.907800     -0.2337000    
 H    4.425600      -2.175200     -0.2186000    
 H    4.216700      -1.322800      -1.740300    
 H    3.108700      -2.051900       1.800100    
 H    3.102400     -0.6104000       2.811400    
 H    1.606400      -1.469800       2.482000    
 H  -0.2895000      -2.795300      -1.331500    
 H   -2.088800      -2.025400       1.709300    
 H   -2.186800     -0.7010000       2.868700    
 H   -3.611500      -1.185500       1.958000    
 H   -2.445500       1.775300       2.092100    
 H    4.636700      0.8127000       1.481700    
 H   0.5633000      0.9307000       3.529300    
 H   -4.267700     -0.3345000      -2.068300    
 H   -2.171600      -3.379200      -2.509400    
 H   -2.945900      -1.927800      -3.141700    
 H   -3.711900      -2.863300      -1.830900    
 H   -4.337000       2.757300      0.9985000    
 H    2.944500       3.663700      -2.562000    
 H    4.706400       3.720500      -2.388100    
 H    3.972300       2.708900      -3.643300    


%chk=000123790-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000123790

0 1
O 4.868755 0.033424 0.992919
O -0.087006 0.386975 2.913775
O -5.680685 1.689077 -0.981566
C 2.316009 -0.212776 0.832433
C 1.473662 -0.901840 -0.285186
C 0.026636 -1.193236 0.179639
C -0.646817 0.168086 0.521972
C 1.641520 1.123791 1.218063
C 3.708738 -0.099292 0.074529
C 0.133001 0.990296 1.576540
C 2.381013 -2.059621 -0.782324
C 3.834434 -1.501295 -0.622433
C -2.193725 -0.024477 0.769901
C 2.515712 -1.107142 2.084279
C -0.783052 -1.937973 -0.859904
C -2.782523 -0.514994 -0.559505
C -2.065498 -1.621920 -1.233042
C -2.500474 -1.116396 1.863217
C -2.848715 1.246712 1.269664
C 3.735510 1.007664 -0.905484
C -3.934867 0.033104 -1.077077
C -2.758678 -2.380269 -2.352404
C -3.967544 1.795247 0.716778
C -4.608549 1.202239 -0.481964
C 3.807134 1.934120 -1.719844
C 3.900053 3.023334 -2.703719
H 1.395261 -0.171741 -1.121094
H 0.083755 -1.816838 1.097977
H -0.574649 0.784807 -0.402021
H 1.716920 1.826493 0.364160
H 2.169073 1.604909 2.070262
H -0.289365 2.018925 1.594157
H 2.158895 -2.331659 -1.828637
H 2.235136 -2.968109 -0.167915
H 4.453265 -2.137934 0.032952
H 4.358211 -1.411656 -1.587838
H 2.963392 -2.083559 1.833371
H 3.210006 -0.612360 2.785900
H 1.557858 -1.276568 2.601558
H -0.282108 -2.778981 -1.359553
H -2.114275 -2.102011 1.553190
H -2.031209 -0.832717 2.817562
H -3.592959 -1.204052 1.996573
H -2.424821 1.666697 2.191651
H 5.048202 0.998319 1.133332
H 0.537542 0.812480 3.554684
H -4.388155 -0.348551 -1.999179
H -2.132634 -3.217249 -2.705483
H -2.963492 -1.724972 -3.220598
H -3.730978 -2.790534 -2.021218
H -4.452798 2.681571 1.142286
H 2.993421 3.655934 -2.693737
H 4.767607 3.675552 -2.492771
H 4.021753 2.624765 -3.727727


