%chk=000052354.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052354

0 1
 O    2.362800      0.4644000      0.3049000    
 O   -2.547500       2.562700     -0.1251000    
 O   -4.214700      -1.822900     -8.6300001E-02
 N   0.1553000       1.304000      0.1145000    
 N   0.4644000     -0.9015000      0.2168000    
 N   -1.912300      -1.523100      6.8499997E-02
 N   -3.406000      0.3753000     -0.1081000    
 C    3.205900     -0.6763000      0.4074000    
 C    4.487500     -0.2945000       1.132000    
 C    3.701600      -1.094200     -0.9688000    
 C    5.340900      0.3910000      6.5800004E-02
 C    4.815600     -9.9200003E-02  -1.283800    
 C    1.055900      0.2753000      0.2171000    
 C   -1.086400      0.7406000      4.4900000E-02
 C  -0.8688000     -0.6087000      0.1099000    
 C   -2.372400       1.348500     -6.9399998E-02
 C   0.4739000       2.712400      8.6700000E-02
 C   -3.245800      -1.056100     -4.4900000E-02
 C   -1.630100      -2.951300      0.1411000    
 C   -4.779900      0.8536000     -0.2231000    
 H    2.710800      -1.496500      0.9406000    
 H    5.003600      -1.194900       1.485900    
 H    4.314800      0.3673000       1.986200    
 H    2.922500      -1.071000      -1.736600    
 H    4.118700      -2.107300     -0.9262000    
 H    6.402000      0.1561000      0.1982000    
 H    5.236200       1.480100      0.1323000    
 H    4.418700      0.7475000      -1.855800    
 H    5.604700     -0.5601000      -1.886300    
 H    1.554500       2.856000      0.1566000    
 H   0.1096000       3.129600     -0.8555000    
 H  -1.5200000E-02   3.193100      0.9378000    
 H   -2.546900      -3.544600      9.6699998E-02
 H   -1.116600      -3.164800       1.083700    
 H  -0.9880000      -3.230100     -0.7001000    
 H   -4.840200       1.943300     -0.2675000    
 H   -5.350000      0.4952000      0.6400000    
 H   -5.224800      0.4300000      -1.129100    


%chk=000052354-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000052354

0 1
O 2.408335 0.533199 0.529025
O -2.649487 2.601690 -0.089832
O -4.213503 -1.849146 -0.273090
N 0.198157 1.342691 0.246135
N 0.480245 -0.938622 0.281058
N -1.903676 -1.530884 -0.000905
N -3.406673 0.350518 -0.179369
C 3.315708 -0.679960 0.608102
C 4.665339 -0.149583 1.105943
C 3.610238 -1.208934 -0.806136
C 5.364878 0.442353 -0.156183
C 4.655694 -0.216021 -1.391544
C 1.081609 0.282715 0.351128
C -1.082224 0.761511 0.098080
C -0.863165 -0.624475 0.123811
C -2.376732 1.360247 -0.055438
C 0.522636 2.775243 0.291876
C -3.231759 -1.059075 -0.160396
C -1.644558 -2.982147 0.032365
C -4.803278 0.813854 -0.342559
H 2.818647 -1.409806 1.268735
H 5.239380 -1.006185 1.507017
H 4.543456 0.582091 1.922151
H 2.695898 -1.309501 -1.413182
H 4.044960 -2.222121 -0.701188
H 6.449541 0.236716 -0.144569
H 5.241535 1.538730 -0.183924
H 4.150708 0.557399 -1.996279
H 5.371866 -0.731684 -2.054779
H 1.612154 2.877842 0.407438
H 0.193322 3.269950 -0.635904
H 0.008300 3.256427 1.139362
H -2.611089 -3.493510 -0.083594
H -1.178228 -3.262453 0.991863
H -0.962853 -3.264644 -0.787473
H -4.785286 1.913400 -0.329109
H -5.429099 0.426248 0.477908
H -5.216699 0.444827 -1.295545


