%chk=000139644.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000139644

0 1
 N    1.901300      0.2475000     -0.7326000    
 C   -2.671500      -1.774000     -0.2973000    
 C   -1.621200     -0.6833000     -0.3266000    
 C   -2.212700      0.5792000     -9.6900001E-02
 C   -3.932400     -0.9812000     -2.3700001E-02
 C   -3.636000      0.3957000      8.9500003E-02
 C  -0.2603000     -0.8162000     -0.5396000    
 C   -1.437400       1.726500     -7.8900002E-02
 C   -5.225200      -1.456000      0.1113000    
 C   -4.642200       1.313600      0.3410000    
 C   0.5210000      0.3405000     -0.5212000    
 C  -6.1500002E-02   1.599200     -0.2930000    
 C   -6.239200     -0.5307000      0.3647000    
 C   -5.950700      0.8403000      0.4784000    
 C    2.632200      7.8900002E-02  0.3262000    
 C    4.098900     -3.7400000E-02  0.2609000    
 C    4.818600     -0.2150000       1.431600    
 C    4.731500      3.2600001E-02 -0.9702000    
 C    6.207700     -0.3254000       1.369900    
 C    6.120600     -7.7900000E-02  -1.031700    
 C    6.858600     -0.2569000      0.1383000    
 H   -2.474000      -2.480300      0.5143000    
 H   -2.733300      -2.278400      -1.266000    
 H   0.1815000      -1.791600     -0.7154000    
 H   -1.872600       2.704800      9.5700003E-02
 H   -5.449300      -2.513300      2.4000000E-02
 H   -4.435100       2.374600      0.4315000    
 H   0.5595000       2.492300     -0.2821000    
 H   -7.264900     -0.8725000      0.4758000    
 H   -6.757500       1.541400      0.6761000    
 H    2.175300      1.4800000E-02   1.332200    
 H    4.322900     -0.2700000       2.396700    
 H    4.180700      0.1713000      -1.895900    
 H    6.782500     -0.4647000       2.280800    
 H    6.628000     -2.4700001E-02  -1.990500    
 H    7.940200     -0.3428000      9.0300001E-02


%chk=000139644-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000139644

0 1
N 1.911564 -0.221496 -0.275640
C -2.899411 -1.754226 -0.724575
C -1.751495 -0.815814 -0.368488
C -2.270223 0.405871 0.165959
C -4.133826 -0.944173 -0.341806
C -3.741056 0.327623 0.180796
C -0.372094 -1.004799 -0.513862
C -1.388288 1.441222 0.551398
C -5.493481 -1.285811 -0.440598
C -4.715334 1.259673 0.605271
C 0.525353 0.020116 -0.093056
C 0.001555 1.245772 0.424755
C -6.470304 -0.350169 -0.014046
C -6.082019 0.911117 0.504149
C 2.812744 0.278147 0.535709
C 4.256908 0.100892 0.308799
C 5.183336 0.650515 1.237520
C 4.748487 -0.609687 -0.823183
C 6.572279 0.495501 1.042098
C 6.134538 -0.764056 -1.015515
C 7.051747 -0.212238 -0.084891
H -2.841150 -2.708308 -0.164880
H -2.896174 -2.019140 -1.800182
H 0.051121 -1.922088 -0.935967
H -1.774038 2.392567 0.934995
H -5.801004 -2.259121 -0.840502
H -4.423183 2.236778 1.006645
H 0.690739 2.056169 0.689139
H -7.534307 -0.602593 -0.084862
H -6.850565 1.621718 0.828742
H 2.535262 0.841758 1.452708
H 4.809462 1.198091 2.112304
H 4.020839 -1.025417 -1.527572
H 7.278415 0.922323 1.762855
H 6.507654 -1.312113 -1.887993
H 8.129948 -0.333703 -0.238625


