%chk=000043674.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043674

0 1
 O   -2.402200      -2.176300      -1.171100    
 O   -3.960000     -0.7677000       1.796800    
 O   -4.206100     -3.7200000E-02  -1.770500    
 O   -3.447200       1.970400       1.166800    
 C   -1.342000     -0.4242000      3.5100002E-02
 C   -2.405100      -1.511600      9.2600003E-02
 C   -3.825800      -1.015800      0.3995000    
 C   -4.173100      0.2535000     -0.3758000    
 C   -3.169600       1.377300     -0.1016000    
 C   -1.725100      0.9282000     -8.1699997E-02
 C   4.8500001E-02 -0.7683000      5.9999999E-02
 C    1.022700      0.2617000     -1.4100000E-02
 C   0.6219000       1.610900     -0.1183000    
 C  -0.7389000       1.924100     -0.1510000    
 C    2.412800     -4.2199999E-02  1.3300000E-02
 C   0.5263000      -2.094900      0.1536000    
 C    2.844700      -1.382500      0.1124000    
 C    3.376000      0.9935000     -5.8800001E-02
 C    1.587500       2.624300     -0.1889000    
 C    1.890100      -2.397100      0.1801000    
 C    2.947200       2.320300     -0.1592000    
 C    4.217000      -1.672700      0.1398000    
 C    4.741900      0.6757000     -2.8999999E-02
 C    5.158700     -0.6494000      6.9899999E-02
 H   -2.131800      -2.235900      0.8692000    
 H   -4.545100      -1.801200      0.1386000    
 H   -5.175300      0.5908000     -8.5299999E-02
 H   -3.295400       2.149100     -0.8721000    
 H   -1.046700       2.966300     -0.2339000    
 H  -0.1607000      -2.936300      0.2067000    
 H    1.289800       3.668100     -0.2688000    
 H    2.192000      -3.439800      0.2543000    
 H   -3.012700      -2.930500      -1.107400    
 H   -3.274700     -0.1336000       2.066200    
 H   -3.307700     -0.2677000      -2.060600    
 H   -2.906100       2.773600       1.252000    
 H    3.666900       3.134200     -0.2163000    
 H    4.564700      -2.700900      0.2158000    
 H    5.494700       1.459200     -8.3099999E-02
 H    6.218800     -0.8847000      9.1899998E-02


%chk=000043674-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000043674

0 1
O -2.396782 -2.127258 -1.275273
O -3.948701 -0.770571 1.866008
O -4.140582 -0.011805 -1.843247
O -3.560808 1.841393 1.321290
C -1.338868 -0.399022 0.029618
C -2.393593 -1.491609 0.093654
C -3.825581 -0.997852 0.427648
C -4.169992 0.259854 -0.405767
C -3.180369 1.394566 -0.066861
C -1.720316 0.964927 -0.094853
C 0.050816 -0.742798 0.051507
C 1.050141 0.296974 -0.025374
C 0.644426 1.675199 -0.155261
C -0.738405 1.975241 -0.198210
C 2.450223 -0.029138 0.009419
C 0.507907 -2.115155 0.145418
C 2.870190 -1.402927 0.123668
C 3.442636 1.015626 -0.072652
C 1.657574 2.705091 -0.245496
C 1.854030 -2.428933 0.185589
C 3.002411 2.388524 -0.201702
C 4.258101 -1.706896 0.162299
C 4.820171 0.669497 -0.029941
C 5.221231 -0.678647 0.088138
H -2.125952 -2.251767 0.851957
H -4.539857 -1.806323 0.176452
H -5.191583 0.601229 -0.167331
H -3.349506 2.235104 -0.764867
H -1.051935 3.019282 -0.334753
H -0.230438 -2.920498 0.163750
H 1.334462 3.747513 -0.348754
H 2.173745 -3.475139 0.258525
H -2.924277 -2.967584 -1.232985
H -3.815096 0.211945 2.029630
H -3.440748 -0.709020 -2.015619
H -2.881258 2.482201 1.651625
H 3.762015 3.176270 -0.267250
H 4.575027 -2.752651 0.248943
H 5.573181 1.463830 -0.091533
H 6.287262 -0.927972 0.119692


