%chk=000133612.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133612

1 1
 O  -0.9269000      -2.654200      -1.319500    
 O   -2.333200       3.067300     -0.3772000    
 N   0.3524000     -0.5184000      5.9099998E-02
 N  -0.9914000      9.4300002E-02  -1.783700    
 N   -1.443900      4.4599999E-02   1.739100    
 N   -3.550400      0.8643000      0.9464000    
 C    1.445700      0.3850000      0.5668000    
 C   0.5606000      -1.962300      0.4349000    
 C  -0.9326000     -5.6699999E-02  0.4827000    
 C    2.769900      3.9600000E-02 -0.1233000    
 C   0.1699000     -0.3668000      -1.429100    
 C   -1.645200      0.2808000     -0.5960000    
 C    1.029300       1.824400      0.2935000    
 C  -0.6582000      -2.804600      7.2499998E-02
 C    3.955400      0.8702000      0.3796000    
 C   -3.054800      0.7917000     -0.4663000    
 C    5.260900      0.4289000     -0.2841000    
 C  -0.5140000      -4.283600      0.4066000    
 C   -2.732000      0.4998000       1.880000    
 C   -3.198800       2.187100      -1.069500    
 C    6.437300       1.268700      0.1877000    
 H    1.532600      0.2243000       1.649500    
 H    1.430300      -2.328300     -0.1204000    
 H   0.7703000      -2.012900       1.510000    
 H    2.704200      0.1876000      -1.206700    
 H    3.024500      -1.012200      4.1000001E-02
 H   0.9459000     -0.6473000      -2.157400    
 H   0.9105000       2.048100     -0.7719000    
 H   0.1276000       2.135000      0.8288000    
 H    1.795800       2.513900      0.6644000    
 H   -1.551600      -2.469700      0.6085000    
 H    4.041700      0.7692000       1.468100    
 H    3.799400       1.931500      0.1598000    
 H   -3.721000      0.1047000      -1.002200    
 H  -0.8672000     -0.2273000       2.526300    
 H    5.457400     -0.6252000     -5.6200001E-02
 H    5.173400      0.5148000      -1.373500    
 H   0.3290000      -4.725200     -0.1358000    
 H   -1.409400      -4.835400      0.1007000    
 H  -0.3565000      -4.433000       1.478900    
 H   -3.048400      0.5361000       2.934200    
 H   -2.953000       2.205800      -2.136800    
 H   -4.222400       2.557200     -0.9503000    
 H  -0.2004000      -3.076300      -1.809700    
 H    6.571600       1.182200       1.270600    
 H    6.288700       2.325300     -5.7200000E-02
 H    7.360000      0.9345000     -0.2970000    
 H   -1.435800       2.935000     -0.7258000    


%chk=000133612-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133612

1 1
O -0.442870 -3.103521 -1.510607
O -2.083031 3.000713 0.040820
N 0.269776 -0.547136 -0.157784
N -1.169225 0.067214 -1.945679
N -1.435791 -0.015743 1.674089
N -3.650275 0.675928 0.941269
C 1.453496 0.477870 0.279025
C 0.576864 -1.990934 0.301433
C -1.035745 -0.053341 0.351548
C 2.831925 -0.016280 -0.205575
C 0.001758 -0.427530 -1.694834
C -1.836666 0.301075 -0.698120
C 1.103039 1.896559 -0.192498
C -0.521964 -3.002709 -0.043004
C 3.975944 0.914325 0.282877
C -3.198225 0.913929 -0.473210
C 5.371102 0.320765 -0.024994
C -0.242110 -4.351816 0.642746
C -2.815869 0.327975 1.869991
C -3.195297 2.434914 -0.741006
C 6.517122 1.250913 0.425458
H 1.409788 0.419530 1.387060
H 1.500054 -2.301924 -0.208990
H 0.755530 -1.944904 1.390264
H 2.855099 -0.062115 -1.311789
H 3.051147 -1.029670 0.177873
H 0.775653 -0.753228 -2.383773
H 1.296569 2.023071 -1.271644
H 0.059419 2.190821 0.017744
H 1.755761 2.604660 0.345462
H -1.518664 -2.623967 0.264881
H 3.884778 1.080371 1.376791
H 3.891011 1.906161 -0.199177
H -3.952145 0.469045 -1.148389
H -0.815207 -0.152448 2.472269
H 5.473295 -0.662813 0.476647
H 5.455701 0.129063 -1.113671
H 0.749205 -4.743482 0.355124
H -0.999919 -5.095447 0.339838
H -0.288365 -4.265398 1.743699
H -3.159018 0.237257 2.906766
H -3.048146 2.618980 -1.823290
H -4.170008 2.846091 -0.416050
H -1.156628 -3.691421 -1.863836
H 6.478621 1.436796 1.514845
H 6.464000 2.229289 -0.086738
H 7.501378 0.806620 0.196212
H -2.225667 3.968391 0.180028


