%chk=000089546.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089546

0 1
 O    2.799300      -2.693600      0.1294000    
 O   0.3700000       1.388900     -6.9399998E-02
 N   -5.186700      0.6481000     -2.1500001E-02
 C    1.150300     -0.9101000      4.3200001E-02
 C    3.423100     -0.3738000      1.1400000E-02
 C    2.708400      0.8272000     -4.6999998E-02
 C    2.504100      -1.520200      7.0900001E-02
 C    1.260800      0.5689000     -3.1199999E-02
 C   -1.350000      -1.005600      5.3399999E-02
 C   5.2000000E-03  -1.589600      7.9800002E-02
 C   -3.891800      9.0000004E-02  3.7000000E-03
 C    4.804300     -0.3957000      9.9999998E-03
 C    3.349300       2.049300     -0.1085000    
 C   -1.976900     -0.6983000       1.248500    
 C   -1.964200     -0.7778000      -1.166100    
 C   -3.257700     -0.1465000       1.223500    
 C   -3.245000     -0.2258000      -1.191200    
 C    5.466900      0.8334000     -5.1899999E-02
 C    4.746900       2.043200     -0.1104000    
 C   -5.618900       1.547600       1.029700    
 C   -6.097500      0.3404000      -1.106300    
 H   2.1000000E-02  -2.675800      0.1357000    
 H    5.361900      -1.324200      5.5199999E-02
 H    2.799100       2.982200     -0.1536000    
 H   -1.493600     -0.8803000       2.204700    
 H   -1.468800      -1.017500      -2.103100    
 H   -3.737900      7.6700002E-02   2.171900    
 H   -3.705000     -4.3400001E-02  -2.158200    
 H    6.553600      0.8588000     -5.4900002E-02
 H    5.288500       2.984400     -0.1578000    
 H   -6.483200       2.141500      0.7115000    
 H   -4.830000       2.259300       1.298200    
 H   -5.915900      0.9872000       1.922300    
 H   -5.862200      0.9392000      -1.992400    
 H   -7.133800      0.5603000     -0.8260000    
 H   -6.062400     -0.7225000      -1.370900    


%chk=000089546-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000089546

0 1
O 2.558278 -1.639312 1.979003
O 0.894864 1.396405 -1.434750
N -5.538857 0.383139 -0.059490
C 1.223441 -0.242088 0.426771
C 3.630997 -0.189570 0.292685
C 3.124559 0.691130 -0.697046
C 2.478722 -0.803867 1.029017
C 1.620139 0.696442 -0.657237
C -1.377458 -0.344823 0.629541
C -0.002818 -0.654801 0.939029
C -4.189152 0.143348 0.166248
C 5.013866 -0.377347 0.464173
C 3.988843 1.408356 -1.542828
C -2.395094 -0.991806 1.407579
C -1.816974 0.559347 -0.394940
C -3.755833 -0.763983 1.193350
C -3.175372 0.794243 -0.618747
C 5.890914 0.342246 -0.384784
C 5.384079 1.224654 -1.376570
C -6.560644 -0.295269 0.754440
C -5.960376 1.311877 -1.121606
H 0.124344 -1.378712 1.763438
H 5.389844 -1.060623 1.232340
H 3.583786 2.084712 -2.302202
H -2.090810 -1.689401 2.198125
H -1.061787 1.067765 -1.004948
H -4.486976 -1.285022 1.817014
H -3.459854 1.491117 -1.411936
H 6.974556 0.219700 -0.278572
H 6.085341 1.768588 -2.019226
H -7.561015 0.032418 0.432953
H -6.450946 -0.052762 1.829611
H -6.508262 -1.396199 0.641438
H -5.568857 2.333201 -0.947974
H -7.059467 1.367908 -1.142877
H -5.614822 0.974887 -2.118426


