%chk=000148981.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148981

1 1
 N  -0.7584000      0.9650000      0.1049000    
 N   -5.416100     -0.1783000      6.3600004E-02
 N    4.254300      -2.424100     -9.6400000E-02
 C   -1.707400      1.5100000E-02  5.8699999E-02
 C   0.5499000      0.7003000      8.5000001E-02
 C    1.011400     -0.6078000      1.3600000E-02
 C   -1.325700      -1.345700     -1.5100000E-02
 C   7.2700001E-02  -1.663700     -3.8300000E-02
 C   -1.171400       2.385500      0.1811000    
 C   -3.057300      0.3972000      8.5000001E-02
 C    2.391500     -0.8684000     -6.3999998E-03
 C    1.418800       1.861900      0.1438000    
 C   -2.375900      -2.294700     -6.0699999E-02
 C   0.5931000      -2.979200     -0.1105000    
 C   -4.060400     -0.5645000      3.8400002E-02
 C    2.867100      -2.174200     -7.7799998E-02
 C   -3.720400      -1.909500     -3.4299999E-02
 C    1.968000      -3.229800     -0.1301000    
 C   -1.331000       2.989300      -1.201200    
 C    1.829000       2.480300      -1.034500    
 C    1.837400       2.352300       1.378100    
 C    2.663600       3.596600     -0.9783000    
 C    2.671900       3.468600       1.434300    
 C   -6.417400      -1.049600      0.6463000    
 C   -5.825200       1.101700     -0.4805000    
 C    4.787300      -3.651100      0.4623000    
 C    5.166000      -1.463900     -0.6873000    
 C    3.084900       4.090700      0.2560000    
 H   -2.055800       2.516500      0.8084000    
 H  -0.4676000       2.983200      0.7601000    
 H   -3.382300       1.426400      0.1168000    
 H    3.107700     -5.3199999E-02  4.9100000E-02
 H   -2.166500      -3.359700     -0.1208000    
 H  -6.7599997E-02  -3.841300     -0.1561000    
 H   -4.474800      -2.689800     -8.4700003E-02
 H    2.297900      -4.262600     -0.1986000    
 H  -0.6037000       2.636500      -1.931300    
 H   -1.277600       4.081200      -1.148200    
 H   -2.314800       2.736000      -1.611200    
 H    1.539400       2.090800      -2.007000    
 H    1.524700       1.877800       2.305100    
 H    2.991400       4.076300      -1.895800    
 H    3.000600       3.853200       2.395300    
 H   -6.063400      -1.498400       1.581300    
 H   -6.692800      -1.846300     -5.2600000E-02
 H   -7.330800     -0.4951000      0.8895000    
 H   -5.638600       1.907300      0.2373000    
 H   -6.897300       1.107400     -0.7081000    
 H   -5.305600       1.326000      -1.419000    
 H    5.857100      -3.553900      0.6791000    
 H    4.296700      -3.907800       1.408100    
 H    4.667800      -4.481900     -0.2410000    
 H    5.373900     -0.6460000      1.0400000E-02
 H    6.123800      -1.932800     -0.9395000    
 H    4.764300      -1.048700      -1.618500    
 H    3.736100       4.958700      0.2998000    


%chk=000148981-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000148981

1 1
N -0.794937 1.112293 0.048705
N -5.521909 -0.265619 0.118148
N 4.259177 -2.430779 0.006929
C -1.792171 0.091994 0.057558
C 0.549332 0.826669 0.044442
C 1.016209 -0.531566 0.042072
C -1.360171 -1.282681 0.063708
C 0.044675 -1.603752 0.049308
C -1.242032 2.548759 0.012524
C -3.169462 0.426399 0.068746
C 2.416963 -0.808459 0.029154
C 1.536463 1.955997 0.050441
C -2.387936 -2.279569 0.085533
C 0.554347 -2.939592 0.042906
C -4.172849 -0.583031 0.097449
C 2.903280 -2.140099 0.022149
C -3.737950 -1.959566 0.103355
C 1.919686 -3.202965 0.029555
C -1.650149 3.006038 -1.401403
C 2.031116 2.485047 -1.169721
C 2.032330 2.456804 1.283230
C 2.991744 3.521326 -1.155303
C 2.990816 3.494492 1.292517
C -6.544741 -1.329700 0.138488
C -5.947666 1.143409 0.118976
C 4.732727 -3.827335 -0.007297
C 5.238272 -1.331841 -0.004925
C 3.469593 4.031001 0.074237
H -2.066165 2.661249 0.735613
H -0.407949 3.164255 0.376217
H -3.482084 1.468039 0.047887
H 3.109994 0.033314 0.022222
H -2.108750 -3.336247 0.092711
H -0.132943 -3.789595 0.046958
H -4.473192 -2.767149 0.122845
H 2.250287 -4.244970 0.023786
H -0.779918 3.004102 -2.079127
H -2.035840 4.039422 -1.351607
H -2.432864 2.365546 -1.840192
H 1.678463 2.078737 -2.124539
H 1.671335 2.034875 2.228099
H 3.367213 3.926008 -2.100844
H 3.364278 3.879552 2.246984
H -6.453587 -1.967481 1.038489
H -6.483441 -1.973798 -0.759572
H -7.543816 -0.870057 0.153723
H -5.555805 1.685633 1.002602
H -7.045531 1.195532 0.152736
H -5.611595 1.672420 -0.795413
H 5.832624 -3.834712 -0.015757
H 4.400627 -4.383824 0.890557
H 4.386055 -4.371029 -0.907629
H 5.139211 -0.689604 0.892745
H 6.256927 -1.746729 -0.013767
H 5.121899 -0.692763 -0.902986
H 4.212307 4.835399 0.083376


