%chk=000002480.chk
%nprocshared=4
%mem=4GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002480

0 1
 O  -0.3102000       1.308000     -0.7624000    
 O  -0.8337000       2.429700       1.178500    
 N    2.730200     -0.3634000     -0.8230000    
 N   -5.970200      -1.243900      0.1003000    
 C    4.018000      0.3201000     -0.8396000    
 C    2.917000      -1.813200     -0.7430000    
 C    1.947500     -1.7100001E-02  -2.010700    
 C    4.803600      3.1999999E-03  0.4317000    
 C    1.564000      -2.522400     -0.7260000    
 C    1.695700       1.486500      -2.059100    
 C    4.051200      0.4723000       1.677600    
 C   0.7336000      -2.099300      0.4862000    
 C   0.9468000       1.967600     -0.8236000    
 C    4.810200      0.1287000       2.949400    
 C  -0.6289000      -2.774100      0.4916000    
 C   -1.105900       1.632500      0.2943000    
 C   -2.383500      0.8776000      0.2433000    
 C   -3.019200      0.5619000       1.426600    
 C   -2.895100      0.5147000     -0.9858000    
 C   -4.218900     -0.1479000       1.378800    
 C   -4.095000     -0.1950000      -1.033700    
 C   -4.757000     -0.5264000      0.1486000    
 H    3.915900       1.408700     -0.8595000    
 H    4.614100      3.3599999E-02  -1.715800    
 H    3.425200      -2.115100      0.1773000    
 H    3.511100      -2.187800      -1.586500    
 H   0.9608000     -0.4860000      -2.022900    
 H    2.461300     -0.3280000      -2.929700    
 H    5.095800      -1.048500      0.5074000    
 H    5.753900      0.5522000      0.3799000    
 H    1.760800      -3.600200     -0.6400000    
 H    1.005300      -2.424300      -1.661400    
 H    2.603200       2.073700      -2.224900    
 H    1.064000       1.677000      -2.937600    
 H    3.895500       1.556700       1.633500    
 H    3.061700      6.5000001E-03   1.740200    
 H   0.5754000      -1.017000      0.5024000    
 H    1.265100      -2.358700       1.409600    
 H    1.514500       1.787900      9.5700003E-02
 H   0.7758000       3.047000     -0.9144000    
 H    4.258600      0.4801000       3.827000    
 H    4.946000     -0.9534000       3.044500    
 H    5.797300      0.6016000       2.956900    
 H   -1.201900      -2.465000       1.371400    
 H   -1.203600      -2.503500     -0.3999000    
 H  -0.5272000      -3.863700      0.5181000    
 H   -2.608000      0.8473000       2.390200    
 H   -2.405600      0.7710000      -1.920500    
 H   -4.724600     -0.4013000       2.307100    
 H   -4.505500     -0.4822000      -1.998500    
 H   -6.450800      -1.483800      0.9572000    
 H   -6.361100      -1.518000     -0.7912000    


%chk=000002480-Freq.chk
%nprocshared=4
%mem=4GB
#p freq=noraman PBEPBE/SDD

000002480

0 1
O -0.583837 1.273894 -0.550958
O -1.110185 1.182096 1.721902
N 2.776454 -0.408376 -1.029004
N -6.587578 -0.951587 -1.076280
C 4.219973 -0.079504 -1.182218
C 2.507174 -1.873187 -1.068492
C 1.911492 0.357438 -1.964583
C 5.043020 -0.293399 0.108716
C 1.254095 -2.286657 -0.262741
C 1.605137 1.787272 -1.462986
C 4.660848 0.676778 1.248014
C 1.436493 -2.144195 1.265037
C 0.767507 1.792926 -0.185253
C 5.436101 0.403452 2.554377
C 0.153777 -2.470390 2.059094
C -1.449635 1.005487 0.521082
C -2.765998 0.501551 0.067529
C -3.740951 0.172735 1.048801
C -3.095530 0.335586 -1.305393
C -5.004262 -0.308029 0.678133
C -4.357103 -0.144459 -1.688286
C -5.335512 -0.475766 -0.701519
H 4.299508 0.986734 -1.470621
H 4.677513 -0.666670 -2.019229
H 3.384814 -2.394555 -0.640824
H 2.412340 -2.231041 -2.125174
H 0.951920 -0.178804 -2.072204
H 2.364384 0.413143 -2.986008
H 4.921435 -1.337169 0.463207
H 6.118815 -0.172701 -0.138005
H 1.009297 -3.341305 -0.509088
H 0.382680 -1.681641 -0.586121
H 2.549666 2.327530 -1.254678
H 1.076918 2.350769 -2.256784
H 4.847930 1.719446 0.915828
H 3.572232 0.593602 1.428977
H 1.762769 -1.110089 1.487116
H 2.260138 -2.812498 1.593754
H 1.208669 1.134271 0.582587
H 0.643888 2.807457 0.235714
H 5.151019 1.116194 3.350034
H 5.230639 -0.617727 2.927886
H 6.528721 0.489637 2.398258
H 0.326398 -2.397219 3.148736
H -0.657481 -1.763663 1.804533
H -0.203474 -3.494964 1.838845
H -3.480206 0.305342 2.104298
H -2.349509 0.590953 -2.063340
H -5.745263 -0.557255 1.447341
H -4.598552 -0.266760 -2.751261
H -7.286333 -1.187016 -0.377203
H -6.829154 -1.070766 -2.055947


