%chk=000023186.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023186

0 1
 O    3.301500      -2.113200      0.5659000    
 O    1.400400      -3.262400      0.9662000    
 N   -3.198800      -1.071000      0.1748000    
 C    1.229000      -1.150400     -0.2969000    
 C  -0.2872000      -1.584900     -0.3134000    
 C    1.805800      -1.091900      -1.774700    
 C  -0.9695000      -1.686300       1.065200    
 C   -2.456700      -2.041600      0.9658000    
 C    1.424200      0.2179000      0.4076000    
 C   -3.203700      0.2587000      0.7837000    
 C   -4.609900      -1.428700      3.2600001E-02
 C   -4.315900      0.9737000      3.0800000E-02
 C   -5.241900     -0.1350000     -0.4598000    
 C    1.953300      -2.279700      0.4858000    
 C    3.289800     -0.6917000      -1.868100    
 C    1.614200      -2.384200      -2.585200    
 C   0.8608000       1.355700     -0.1249000    
 C    2.175100      0.1848000       1.554700    
 C    1.075800       2.572400      0.5653000    
 C    2.386000       1.381400       2.233500    
 C   9.5700003E-02   1.360000      -1.302600    
 C    1.840500       2.568200       1.743200    
 C   0.5191000       3.757600      5.7500001E-02
 C  -0.4495000       2.547000      -1.792800    
 C  -0.2381000       3.743600      -1.114200    
 H  -0.8993000     -0.9688000     -0.9659000    
 H  -0.3598000      -2.588200     -0.7559000    
 H    1.316300     -0.3498000      -2.394400    
 H  -0.8538000     -0.7442000       1.612000    
 H  -0.5149000      -2.446900       1.702400    
 H   -2.542900      -3.031300      0.4995000    
 H   -2.871700      -2.131100       1.978300    
 H   -2.256500      0.7913000      0.6634000    
 H   -3.449200      0.2174000       1.852700    
 H   -5.055700      -1.715800      0.9936000    
 H   -4.759100      -2.246500     -0.6794000    
 H   -4.841900       1.687100      0.6731000    
 H   -3.913000       1.526000     -0.8264000    
 H   -5.292500     -0.1182000      -1.554800    
 H   -6.259300     -1.3500000E-02 -7.4699998E-02
 H    3.963900      -1.516400      -1.620400    
 H    3.529700     -0.4064000      -2.900200    
 H    3.535400      0.1707000      -1.243100    
 H    2.061900      -3.247400      -2.082900    
 H    2.083600      -2.297900      -3.572100    
 H   0.5548000      -2.594300      -2.758800    
 H    2.563500     -0.6848000       2.062700    
 H    2.958800       1.390900       3.156600    
 H  -0.1972000      0.5068000      -1.887200    
 H    2.014600       3.491100       2.292600    
 H    3.732300      -2.851800       1.046600    
 H   0.6705000       4.704200      0.5721000    
 H   -1.052200       2.537000      -2.696600    
 H  -0.6660000       4.666600      -1.494400    


%chk=000023186-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000023186

0 1
O 3.453279 -2.152378 0.376196
O 1.629411 -3.483432 0.807582
N -3.152601 -0.955375 0.253886
C 1.242203 -1.290399 -0.329365
C -0.266992 -1.726289 -0.266567
C 1.730287 -1.319823 -1.862413
C -0.921783 -1.735059 1.131661
C -2.443382 -1.986470 1.040994
C 1.416351 0.087911 0.376929
C -3.185210 0.400858 0.862728
C -4.574867 -1.276026 -0.030142
C -4.227812 1.164827 0.004380
C -5.145476 0.047489 -0.601687
C 2.066053 -2.397492 0.364379
C 2.976833 -0.453684 -2.149980
C 1.945729 -2.761678 -2.396779
C 0.815367 1.318712 -0.125731
C 2.088438 0.149114 1.608650
C 0.973176 2.548320 0.641923
C 2.233206 1.353352 2.358656
C 0.054055 1.420769 -1.343799
C 1.691323 2.541070 1.880521
C 0.402424 3.776175 0.165464
C -0.494634 2.628066 -1.781108
C -0.319429 3.826654 -1.025490
H -0.865266 -1.054584 -0.905785
H -0.354527 -2.741777 -0.696788
H 0.884809 -0.908865 -2.444832
H -0.739115 -0.775659 1.651101
H -0.473858 -2.530897 1.754170
H -2.623080 -2.965516 0.553511
H -2.861973 -2.058523 2.080159
H -2.188514 0.873229 0.838087
H -3.517167 0.353481 1.933139
H -5.126346 -1.558117 0.905363
H -4.649663 -2.124372 -0.734288
H -4.794198 1.889503 0.615335
H -3.721304 1.727911 -0.798459
H -5.078133 0.052484 -1.703261
H -6.207375 0.179796 -0.329269
H 3.839502 -0.797547 -1.555159
H 3.240815 -0.529322 -3.221901
H 2.801323 0.610234 -1.918414
H 2.867331 -3.214875 -1.988501
H 2.055555 -2.728563 -3.496120
H 1.098811 -3.430800 -2.164410
H 2.539155 -0.753636 2.026212
H 2.776190 1.329472 3.309615
H -0.116797 0.535999 -1.955820
H 1.797886 3.477890 2.439987
H 3.901838 -2.950818 0.770678
H 0.546571 4.681905 0.767022
H -1.067077 2.653208 -2.715105
H -0.751046 4.769345 -1.378756


