%chk=000093825.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093825

0 1
 O    5.449200      0.3444000      0.5500000    
 N  -0.6838000      -1.687400     -6.5099999E-02
 C   -2.332000      0.2041000      8.3099999E-02
 C  -0.8746000     -0.2405000      0.1429000    
 C   -3.338100     -0.6961000      8.7600000E-02
 C   -2.601600       1.691900      6.6200003E-02
 C   -4.791500     -0.3066000     -1.2800000E-02
 C   -3.064400      -2.172800      0.2217000    
 C   -4.053900       2.061400      0.3713000    
 C   -5.011500       1.157400     -0.3912000    
 C   -1.644800      -2.469100      0.7033000    
 C  -1.5000000E-03  0.4646000     -0.9011000    
 C    1.449400      0.4324000     -0.5148000    
 C    1.978200       1.461700      0.2543000    
 C    2.247500     -0.6264000     -0.9307000    
 C    3.325700       1.432000      0.6130000    
 C    3.595100     -0.6563000     -0.5720000    
 C    4.134300      0.3728000      0.2000000    
 C    6.218600     -0.7674000      9.4200000E-02
 H  -0.5191000      1.1400000E-02   1.152500    
 H   -1.954400       2.197500      0.7925000    
 H   -2.355600       2.085700     -0.9272000    
 H   -5.294700     -0.9377000     -0.7549000    
 H   -5.269600     -0.5041000      0.9549000    
 H   -3.770000      -2.618400      0.9331000    
 H   -3.236900      -2.650300     -0.7510000    
 H   -4.240500       1.968900       1.448900    
 H   -4.231900       3.109600      0.1059000    
 H   -4.857200       1.287300      -1.470000    
 H   -6.048800       1.441600     -0.1815000    
 H   -1.544500      -2.253700       1.774600    
 H   -1.435400      -3.536400      0.5714000    
 H   0.2570000      -1.951800      0.2245000    
 H  -0.2744000       1.518400      -1.026000    
 H  -0.1398000      2.5800001E-02  -1.899700    
 H    1.357200       2.290000      0.5841000    
 H    1.843700      -1.428900      -1.541700    
 H    3.740000       2.236100       1.215000    
 H    4.166300      -1.506600     -0.9286000    
 H    5.852000      -1.710000      0.5150000    
 H    7.239500     -0.6277000      0.4646000    
 H    6.276200     -0.7956000     -0.9992000    


%chk=000093825-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000093825

0 1
O 5.596551 0.032809 0.504823
N -0.629887 -1.426484 0.349442
C -2.412015 0.291217 0.131301
C -0.925553 0.019034 0.377767
C -3.335991 -0.713704 0.077092
C -2.804629 1.759290 -0.006462
C -4.813381 -0.459669 -0.200783
C -2.956397 -2.166280 0.327485
C -4.321090 1.993269 0.170170
C -5.113166 0.977345 -0.680934
C -1.607359 -2.267490 1.062623
C -0.015246 0.732238 -0.678962
C 1.467339 0.532025 -0.406258
C 2.140678 1.318207 0.570395
C 2.219336 -0.452868 -1.091216
C 3.505669 1.129771 0.851768
C 3.594323 -0.658920 -0.824707
C 4.238785 0.137328 0.152860
C 6.397364 -0.971080 -0.197444
H -0.675276 0.478626 1.374712
H -2.240035 2.360390 0.737255
H -2.493851 2.144264 -1.001488
H -5.169625 -1.195966 -0.951799
H -5.394007 -0.676701 0.722765
H -3.752568 -2.659478 0.923665
H -2.892693 -2.712353 -0.635873
H -4.595933 1.865686 1.236725
H -4.581042 3.031330 -0.112711
H -4.813876 1.085101 -1.742865
H -6.200178 1.178803 -0.627664
H -1.754129 -1.956663 2.128004
H -1.242355 -3.311080 1.066832
H 0.348001 -1.620374 0.595795
H -0.246695 1.813409 -0.672779
H -0.287173 0.330013 -1.671709
H 1.586650 2.095610 1.111572
H 1.722815 -1.069492 -1.849501
H 4.026635 1.737706 1.598043
H 4.141041 -1.427525 -1.379603
H 6.009136 -1.993657 -0.021463
H 7.408322 -0.881060 0.226791
H 6.430903 -0.771429 -1.286565


