%chk=000084237.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084237

0 1
 O    1.203600      -1.746100     -0.4433000    
 O   -3.124700       1.078400     -0.8831000    
 O    2.115100       2.684400       1.453500    
 O   0.3534000       2.929700       2.744000    
 O    2.352300       1.707900      -2.345800    
 O  -0.6133000      -1.196100       2.353600    
 O    3.457300     -0.1772000      -2.094900    
 O   -2.494600      -2.006000       1.554000    
 O    1.907500      -3.426100      0.9771000    
 O   -2.346200     -0.6158000      -2.245700    
 N   0.3409000       1.318200       1.155400    
 N    2.084000      0.5190000     -0.4488000    
 N   -1.753600     -2.0600000E-02  0.7925000    
 N   0.9722000       2.388100       1.820700    
 N    2.657000      0.6871000      -1.717900    
 N   -1.617800      -1.137500       1.634400    
 C   0.7399000       1.122600     -0.2647000    
 C   -1.135200       1.235200       1.296700    
 C    2.176200     -0.8415000      0.1146000    
 C   -3.115900      0.1930000      0.2578000    
 C    1.185000      -3.002000      8.5400000E-02
 C   -2.715400      0.5366000      -2.065100    
 C   0.1242000      -3.814100     -0.5927000    
 C   -2.752000       1.582700      -3.137600    
 H   2.8999999E-02  0.4941000     -0.8127000    
 H   0.6724000       2.107400     -0.7478000    
 H   -1.438500       1.357500       2.345800    
 H   -1.554900       2.099200      0.7637000    
 H    2.010500     -0.7831000       1.197600    
 H    3.181900      -1.265300     -4.4999998E-03
 H   -3.602800     -0.7380000     -5.8499999E-02
 H   -3.759800      0.6407000       1.024300    
 H  -0.8253000      -3.273000     -0.5873000    
 H  -1.5699999E-02  -4.753200     -4.9800001E-02
 H   0.4304000      -4.036700      -1.617600    
 H   -3.760700       1.995400      -3.220200    
 H   -2.485400       1.128600      -4.096200    
 H   -2.030300       2.370900      -2.909100    


%chk=000084237-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000084237

0 1
O 0.455663 -1.412035 -0.276056
O -2.132405 0.697983 -1.127994
O 2.413667 2.009354 2.010855
O 0.778643 1.980184 3.620662
O 1.234139 2.125244 -2.517798
O -0.541843 -0.838157 2.736709
O 1.995643 -0.042864 -2.677247
O -2.123628 -1.946898 1.501475
O 2.019259 -3.121983 -0.602906
O -2.771214 -1.389283 -1.971952
N 0.215235 1.717597 1.369605
N 1.293515 0.802599 -0.642070
N -1.846486 0.351492 1.254125
N 1.194437 1.915794 2.411033
N 1.531016 0.964064 -2.022734
N -1.481633 -0.901291 1.862602
C 0.640507 1.983613 0.008810
C -1.195049 1.554075 1.773367
C 1.590343 -0.469902 -0.036225
C -2.797147 0.363704 0.163263
C 0.827304 -2.761457 -0.561654
C -2.182164 -0.305072 -2.144719
C -0.398152 -3.616852 -0.750651
C -1.454407 0.143597 -3.384410
H -0.254007 2.245417 -0.582336
H 1.351323 2.827125 -0.012823
H -1.192823 1.550133 2.875656
H -1.792309 2.407651 1.405426
H 1.695305 -0.334930 1.049495
H 2.505290 -0.906857 -0.469187
H -3.272643 -0.628709 0.088282
H -3.538924 1.162841 0.321799
H -0.890741 -3.766059 0.227339
H -0.101108 -4.591494 -1.163784
H -1.136955 -3.124634 -1.403871
H -1.264975 1.226244 -3.384654
H -2.039145 -0.144381 -4.272932
H -0.482831 -0.381456 -3.446701


