%chk=000002353.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002353

1 1
 O   -6.154700      3.6200002E-02 -0.1051000    
 O   -5.031700      -2.062500      0.2639000    
 O    4.280100       1.461000      0.3240000    
 O    5.797400     -0.7744000     -0.1678000    
 N   9.5899999E-02   1.217200      0.2729000    
 C  -0.6730000       2.449900      0.5795000    
 C   -1.885000       2.537400     -0.3278000    
 C  -0.5360000      3.1700000E-02  3.2099999E-02
 C   -2.698600       1.284100     -0.1679000    
 C   -2.012300      5.3300001E-02  2.2600001E-02
 C    1.446500       1.297200      0.2928000    
 C   0.2405000      -1.111700     -0.2228000    
 C    2.253400      0.1867000      5.0999999E-02
 C    1.637600      -1.045800     -0.2148000    
 C   -4.100000       1.343600     -0.2358000    
 C   -2.781800      -1.115700      0.1844000    
 C   -4.801200      0.1699000     -8.0100000E-02
 C   -4.160300      -1.025100      0.1287000    
 C    3.655200      0.2729000      6.6900000E-02
 C    2.437100      -2.174200     -0.4652000    
 C    4.437400     -0.8549000     -0.1818000    
 C   -6.294400      -1.382000      0.1152000    
 C    3.828800      -2.077700     -0.4482000    
 C    4.571700       2.290500     -0.7965000    
 C    6.447600      -1.007500       1.080000    
 H  -3.1599998E-02   3.324100      0.4286000    
 H  -0.9443000       2.384900       1.640200    
 H   -1.581200       2.632700      -1.377000    
 H   -2.473200       3.422300     -6.0699999E-02
 H    1.854200       2.276000      0.5192000    
 H  -0.2390000      -2.062600     -0.4445000    
 H   -4.616200       2.283900     -0.3976000    
 H   -2.324000      -2.084700      0.3564000    
 H    1.980700      -3.139300     -0.6746000    
 H   -6.830400      -1.818400     -0.7355000    
 H   -6.887500      -1.539700       1.023400    
 H    4.430200      -2.961300     -0.6442000    
 H    5.002300       3.225300     -0.4271000    
 H    3.664100       2.524700      -1.361500    
 H    5.302700       1.805800      -1.451000    
 H    6.244900      -2.023400       1.433800    
 H    6.121800     -0.2772000       1.827400    
 H    7.525100     -0.8976000      0.9306000    


%chk=000002353-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000002353

1 1
O -6.294412 -0.045024 -0.037846
O -5.153592 -2.138245 0.252798
O 4.209127 1.514286 0.243389
O 5.801709 -0.953336 -0.214461
N 0.062221 1.240463 0.272791
C -0.726677 2.465780 0.640167
C -1.975164 2.575320 -0.243178
C -0.640721 0.040724 0.014753
C -2.804012 1.308886 -0.108659
C -2.113150 0.066572 0.046925
C 1.421668 1.305574 0.251927
C 0.124607 -1.098424 -0.278994
C 2.217868 0.174224 -0.018842
C 1.547078 -1.082786 -0.301916
C -4.219605 1.358302 -0.153512
C -2.845839 -1.159116 0.179634
C -4.910373 0.149370 -0.039070
C -4.231682 -1.083886 0.129796
C 3.655531 0.261965 -0.028751
C 2.340873 -2.229715 -0.613561
C 4.405292 -0.914407 -0.248217
C -6.503998 -1.519311 0.120651
C 3.732597 -2.135591 -0.580318
C 5.224988 2.031491 -0.724018
C 6.444281 -0.585533 1.080611
H -0.065362 3.339456 0.528352
H -1.016177 2.368458 1.703188
H -1.679985 2.743685 -1.298015
H -2.554671 3.459344 0.073176
H 1.886785 2.270049 0.466664
H -0.394716 -2.026702 -0.527121
H -4.752813 2.304900 -0.272263
H -2.354305 -2.119635 0.347052
H 1.855776 -3.179677 -0.857084
H -6.994287 -1.907431 -0.786515
H -7.077254 -1.698728 1.043493
H 4.365158 -3.004685 -0.787283
H 5.632983 2.934540 -0.249517
H 4.721753 2.286936 -1.672966
H 6.016865 1.286996 -0.905434
H 6.186460 -1.340546 1.843754
H 6.130307 0.417780 1.417896
H 7.523665 -0.606724 0.876626


