%chk=000063400.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063400

0 1
 O   -3.762400      -3.165400     -0.9713000    
 O    2.307300       2.226700     -0.5787000    
 N   -1.907100      -1.669300      0.5847000    
 N   0.4617000      0.9867000      0.1993000    
 N   0.7521000      -1.325300      0.6798000    
 C   -1.900900      -1.611700     -0.8838000    
 C   -3.263600      -1.955700       1.071600    
 C   -1.403800     -0.4214000       1.155100    
 C   -2.441800      -2.918900      -1.455900    
 C   -3.771500      -3.255400      0.4538000    
 C   1.0800000E-02 -0.2610000      0.6364000    
 C    1.811100       1.181600     -0.1644000    
 C    2.669400     -1.9300001E-02 -8.9000002E-02
 C    2.096200      -1.227700      0.3067000    
 C  -0.4221000       2.111000      5.5500001E-02
 C    4.024700      4.9899999E-02 -0.4329000    
 C    2.898000      -2.374000      0.3559000    
 C   -1.098600       2.302900      -1.142700    
 C  -0.5889000       2.992900       1.115700    
 C    4.812400      -1.099100     -0.3791000    
 C    4.249500      -2.311000      1.4000000E-02
 C   -1.956000       3.394200      -1.282800    
 C   -1.446300       4.084300      0.9757000    
 C   -2.129900       4.285000     -0.2236000    
 H  -0.9025000      -1.467500      -1.307600    
 H   -2.531500     -0.7813000      -1.229100    
 H   -3.944400      -1.136100      0.8067000    
 H   -3.261900      -2.056900       2.162900    
 H   -2.055600      0.4205000      0.9134000    
 H   -1.340800     -0.5004000       2.247100    
 H   -2.496600      -2.853800      -2.547400    
 H   -1.794700      -3.768700      -1.206200    
 H   -3.169700      -4.116200      0.7703000    
 H   -4.803600      -3.439400      0.7689000    
 H    4.482300      0.9842000     -0.7459000    
 H    2.472900      -3.325900      0.6655000    
 H  -0.9696000       1.613500      -1.972700    
 H  -6.0899999E-02   2.844000       2.053600    
 H    5.864200      -1.049600     -0.6452000    
 H    4.862300      -3.206700      5.6299999E-02
 H   -2.488400       3.550100      -2.216500    
 H   -1.581900       4.777700       1.800500    
 H   -2.797600       5.134500     -0.3325000    


%chk=000063400-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000063400

0 1
O -3.872825 -3.918186 -0.232200
O 2.393824 2.514207 0.126657
N -2.091816 -1.654071 0.160912
N 0.519171 1.093586 0.033314
N 0.719676 -1.298178 -0.154021
C -1.962530 -2.536130 -1.030011
C -3.503355 -1.617273 0.627474
C -1.551825 -0.303313 -0.038437
C -2.471125 -3.944564 -0.691458
C -3.981752 -3.044038 0.945551
C -0.025805 -0.212914 -0.054026
C 1.942256 1.337781 0.036490
C 2.759546 0.116324 -0.070306
C 2.119781 -1.160177 -0.161750
C -0.342148 2.267937 0.133248
C 4.175747 0.209969 -0.082016
C 2.920726 -2.331302 -0.263742
C -0.880020 2.842969 -1.038422
C -0.605719 2.830458 1.401358
C 4.954216 -0.954436 -0.184469
C 4.321469 -2.227118 -0.274891
C -1.707121 3.983632 -0.936548
C -1.432771 3.971131 1.497479
C -1.987749 4.546299 0.330261
H -0.897225 -2.585018 -1.308593
H -2.550406 -2.130006 -1.893131
H -4.183982 -1.169619 -0.141256
H -3.568135 -0.999781 1.544133
H -1.935814 0.176244 -0.978486
H -1.919602 0.339418 0.783987
H -2.467519 -4.593003 -1.583106
H -1.828414 -4.388023 0.098653
H -3.373866 -3.458290 1.778712
H -5.048977 -3.051047 1.223534
H 4.629523 1.203784 -0.009469
H 2.413354 -3.298557 -0.327534
H -0.636460 2.413505 -2.016091
H -0.154321 2.387017 2.295000
H 6.047089 -0.886294 -0.194086
H 4.933327 -3.132666 -0.352439
H -2.123639 4.435180 -1.843281
H -1.636139 4.413530 2.478513
H -2.626345 5.433035 0.406593


