%chk=000040902.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040902

0 1
 N   -2.919800      0.1284000      0.8900000    
 C  -0.5793000      0.4590000      0.4277000    
 C   -1.989100       1.077200      0.2414000    
 C  -0.4630000     -0.9176000     -0.2620000    
 C   -3.019900     -0.9618000     -9.8099999E-02
 C   -1.712300      -1.778600      6.6999998E-03
 C   -2.459300       1.111500      -1.219600    
 C   -3.138700     -0.2419000      -1.444700    
 C   0.5551000       1.369900     -6.3100003E-02
 C   0.8304000      -1.610300      0.1821000    
 C    1.907600      0.6963000      6.0000003E-04
 C    2.036300     -0.7048000      8.0200002E-02
 C   -4.212900      0.7282000       1.208800    
 C    3.062700       1.489800     -7.5499997E-02
 C    3.317000      -1.277000      0.1189000    
 C    4.329000      0.9069000     -4.6599999E-02
 C    4.456100     -0.4754000      5.3100001E-02
 H  -0.4294000      0.3119000       1.509700    
 H   -2.013800       2.070600      0.7041000    
 H  -0.3931000     -0.7600000      -1.348100    
 H   -3.869600      -1.627900      8.8900000E-02
 H   -1.737700      -2.613200     -0.7045000    
 H   -1.651100      -2.222800       1.009200    
 H   -1.651100       1.278300      -1.936800    
 H   -3.192200       1.913900      -1.366700    
 H   -4.191300     -8.2699999E-02  -1.707700    
 H   -2.676200     -0.7995000      -2.265500    
 H   0.5697000       2.277800      0.5528000    
 H   0.3864000       1.678900      -1.100900    
 H   0.9862000      -2.502900     -0.4364000    
 H   0.7432000      -1.940400       1.225100    
 H   -4.739400       1.138300      0.3411000    
 H   -4.081900       1.535700       1.937600    
 H   -4.865000     -1.5799999E-02   1.679300    
 H    2.979500       2.571000     -0.1569000    
 H    3.432600      -2.355200      0.1997000    
 H    5.215700       1.531700     -0.1018000    
 H    5.442100     -0.9301000      7.9400003E-02


%chk=000040902-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000040902

0 1
N -2.976029 0.135104 0.910557
C -0.584879 0.458769 0.465374
C -1.997873 1.067694 0.257835
C -0.473139 -0.921800 -0.237753
C -3.032186 -0.980630 -0.093459
C -1.722776 -1.795917 0.042420
C -2.429056 1.113619 -1.255400
C -3.136560 -0.262780 -1.489607
C 0.559282 1.383390 0.000710
C 0.835671 -1.614356 0.195455
C 1.929600 0.706816 0.016916
C 2.060047 -0.710259 0.076775
C -4.293874 0.749178 1.193987
C 3.101306 1.503151 -0.056802
C 3.356836 -1.284633 0.050495
C 4.386892 0.923226 -0.078056
C 4.515964 -0.484673 -0.026042
H -0.487198 0.287159 1.557364
H -2.048395 2.062033 0.739502
H -0.412889 -0.736852 -1.332349
H -3.903502 -1.626993 0.114908
H -1.741990 -2.664498 -0.646360
H -1.674364 -2.188595 1.076884
H -1.566184 1.256351 -1.930040
H -3.122363 1.954400 -1.435201
H -4.193744 -0.122920 -1.777922
H -2.651800 -0.853157 -2.287628
H 0.589946 2.294760 0.631085
H 0.351955 1.735792 -1.032549
H 0.995599 -2.538719 -0.394754
H 0.727335 -1.940131 1.252478
H -4.825035 1.159312 0.300934
H -4.159759 1.573327 1.917388
H -4.950946 -0.006038 1.661524
H 2.998777 2.595451 -0.097628
H 3.453705 -2.377383 0.090779
H 5.277626 1.559120 -0.134453
H 5.507502 -0.950918 -0.045865


