%chk=000048265.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048265

0 1
 O   3.8100000E-02   1.420300       1.506700    
 O    1.150500       2.332800     -0.2903000    
 N   -3.527700     -0.4667000     -0.8537000    
 C    1.985000      0.2784000      0.7842000    
 C    1.343600      -1.065900      0.7079000    
 C    3.242100      0.3959000     -8.9699998E-02
 C   -2.059000       2.079300      0.5357000    
 C    1.030800       1.465400      0.5658000    
 C  -0.9145000       2.487000       1.453000    
 C   -2.770900      0.8283000       1.047500    
 C   0.2307000      -1.262300     -0.1099000    
 C    4.333500       1.055500      0.4204000    
 C    1.856300      -2.126700       1.454500    
 C    3.220400     -0.1634000      -1.344000    
 C   -3.875900      0.3962000      0.1180000    
 C  -0.3693000      -2.519600     -0.1809000    
 C    5.475100       1.162200     -0.3739000    
 C    1.256400      -3.383900       1.383300    
 C    4.362100     -5.6600001E-02  -2.138100    
 C   0.1437000      -3.580400      0.5657000    
 C    5.489400      0.6062000      -1.653100    
 C   -5.144100      0.8990000      0.3153000    
 C   -6.141000      0.4806000     -0.5592000    
 C   -4.522800     -0.8508000      -1.684300    
 C   -5.832600     -0.4110000      -1.580800    
 H    2.319000      0.4073000       1.826900    
 H   -1.674300       1.889100     -0.4740000    
 H   -2.769900       2.910600      0.4570000    
 H   -1.280100       2.651300       2.472400    
 H  -0.4547000       3.425800       1.123800    
 H   -2.067400     -3.8000001E-03   1.157500    
 H   -3.178900       1.008600       2.050300    
 H  -0.1808000     -0.4610000     -0.7171000    
 H    4.329500       1.493500       1.413400    
 H    2.723400      -1.988300       2.095000    
 H    2.354600     -0.6656000      -1.758900    
 H   -1.233200      -2.674100     -0.8207000    
 H    6.352700       1.679300      3.1999999E-03
 H    1.656100      -4.210000       1.964100    
 H    4.372000     -0.4849000      -3.136200    
 H  -0.3228000      -4.559600      0.5094000    
 H    6.377900      0.6908000      -2.272000    
 H   -5.372200       1.595300       1.114500    
 H   -7.156100      0.8489000     -0.4452000    
 H   -4.230300      -1.546700      -2.463800    
 H   -6.593500     -0.7505000      -2.274100    


%chk=000048265-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000048265

0 1
O 0.164378 1.903123 0.698997
O 0.755499 1.314277 -1.479515
N -3.693341 -0.307550 -0.104239
C 1.706023 0.070281 0.462384
C 1.226954 -1.355237 0.106188
C 3.188304 0.336341 0.173703
C -2.114820 2.333884 -0.209651
C 0.849248 1.128633 -0.247069
C -0.756618 2.949465 0.152334
C -2.840222 1.701841 1.008701
C -0.153633 -1.623502 -0.083862
C 4.074233 0.622485 1.240780
C 2.143917 -2.434307 0.058049
C 3.695559 0.300085 -1.151143
C -4.012579 0.839896 0.581305
C -0.602404 -2.940446 -0.322496
C 5.445477 0.866758 0.995350
C 1.693405 -3.752758 -0.179708
C 5.063123 0.546911 -1.397749
C 0.317622 -4.012629 -0.371576
C 5.944095 0.829667 -0.326404
C -5.358043 1.194839 0.854694
C -6.402664 0.351737 0.413350
C -4.711010 -1.110643 -0.526711
C -6.076692 -0.827058 -0.294271
H 1.539426 0.215899 1.546215
H -1.967583 1.561587 -0.985615
H -2.746277 3.127070 -0.657803
H -0.830543 3.682718 0.972645
H -0.282488 3.406639 -0.733996
H -2.114541 1.067118 1.550901
H -3.179467 2.492473 1.703990
H -0.899555 -0.820352 -0.051852
H 3.690152 0.654152 2.267942
H 3.212999 -2.244840 0.200803
H 3.011695 0.091106 -1.980516
H -1.673477 -3.121582 -0.466956
H 6.118762 1.085493 1.831881
H 2.417996 -4.574442 -0.215017
H 5.442391 0.519827 -2.425554
H -0.031789 -5.034607 -0.557699
H 7.005738 1.020041 -0.520611
H -5.575825 2.115693 1.405907
H -7.447719 0.609065 0.617017
H -4.412451 -2.014105 -1.071791
H -6.852357 -1.509248 -0.655733


