%chk=000002400.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002400

0 1
 O   -2.322100      -2.986200     -0.4398000    
 O    2.271500      -3.026200     -0.4887000    
 N  -3.1099999E-02  -3.391900     -0.6211000    
 N   -2.865600      0.8554000       2.030800    
 N    2.953600      0.7705000       1.985800    
 C  -0.6758000      -1.381000      0.2554000    
 C   0.6686000      -1.388900      0.2293000    
 C   -1.570400     -0.3560000      0.6958000    
 C    1.591400     -0.3873000      0.6654000    
 C   -2.134800      0.7012000     -7.1400002E-02
 C    2.140900      0.6885000     -9.0300001E-02
 C   -1.150500      -2.673800     -0.3011000    
 C    1.107900      -2.690900     -0.3367000    
 C   -2.943200       1.446300      0.7897000    
 C    2.990800       1.397900      0.7610000    
 C   -2.038300     -0.2344000       1.984000    
 C    2.111800     -0.3082000       1.938400    
 C   -2.035200       1.097000      -1.420100    
 C    1.994400       1.126100      -1.421500    
 C  -6.2399998E-02  -4.721800      -1.197600    
 C   -3.659800       2.571900      0.3679000    
 C    3.704600       2.527700      0.3456000    
 C   -2.746400       2.220800      -1.856200    
 C    2.702200       2.254700      -1.851000    
 C   -3.545600       2.945500     -0.9742000    
 C    3.543600       2.943200     -0.9793000    
 H   -1.859400     -0.8224000       2.874000    
 H    1.960400     -0.9210000       2.816700    
 H   -3.349500       1.180100       2.856500    
 H    3.472700       1.064400       2.801500    
 H   -1.417800      0.5426000      -2.121200    
 H    1.343800      0.6003000      -2.114500    
 H   0.9481000      -5.119200      -1.318200    
 H  -0.5623000      -4.667400      -2.169100    
 H  -0.6504000      -5.374300     -0.5456000    
 H   -4.282200       3.136600       1.053800    
 H    4.359800       3.064400       1.023500    
 H   -2.673300       2.530500      -2.895300    
 H    2.593200       2.596700      -2.876800    
 H   -4.089300       3.815100      -1.334200    
 H    4.083800       3.817300      -1.333900    


%chk=000002400-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000002400

0 1
O -2.271153 -2.567006 -1.148499
O 2.090885 -3.603998 0.162020
N -0.141290 -3.412975 -0.598686
N -1.890674 1.997003 1.207689
N 3.915170 -0.100447 1.729768
C -0.483051 -1.131482 -0.124559
C 0.838573 -1.437110 0.212353
C -1.247904 0.080015 0.134373
C 1.941169 -0.617867 0.690791
C -2.393700 0.655696 -0.580656
C 2.252597 0.790572 0.431030
C -1.112446 -2.385065 -0.691285
C 1.058498 -2.909556 -0.046358
C -2.761173 1.861664 0.113773
C 3.492472 1.082670 1.100837
C -0.986308 0.945739 1.214721
C 3.002390 -1.115493 1.473434
C -3.129703 0.302234 -1.743197
C 1.649052 1.815192 -0.345762
C -0.351486 -4.796785 -1.021853
C -3.812495 2.705161 -0.303223
C 4.114875 2.346928 1.048724
C -4.177443 1.140874 -2.171607
C 2.265454 3.082130 -0.406469
C -4.519528 2.328795 -1.462366
C 3.479401 3.350765 0.288127
H -0.222745 0.858347 1.983680
H 3.150407 -2.129502 1.835500
H -1.908900 2.758529 1.882828
H 4.771503 -0.206550 2.269654
H -2.905198 -0.624811 -2.274401
H 0.727329 1.624362 -0.901292
H 0.561547 -5.362424 -0.775285
H -0.536939 -4.851651 -2.108583
H -1.216888 -5.235976 -0.496751
H -4.070523 3.617148 0.246692
H 5.061115 2.543860 1.564901
H -4.750479 0.869101 -3.064919
H 1.805702 3.874949 -1.006655
H -5.343744 2.955238 -1.821095
H 3.933329 4.345527 0.219906


