%chk=000035758.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035758

0 1
 O    2.047500      0.1261000      -2.326600    
 N   -3.753700     -5.1700000E-02 -0.8402000    
 C   -1.397000     -9.4899997E-02  0.6186000    
 C   -2.267100       1.131000      0.7310000    
 C   -2.140300      -1.399200      0.5745000    
 C  -6.2899999E-02 -1.6400000E-02  0.5151000    
 C   -3.719400      0.8547000      0.3092000    
 C   -3.237800      -1.389600     -0.5038000    
 C   0.7468000      -1.261300      0.4068000    
 C   0.5938000       1.313900      0.3867000    
 C    2.404000      0.1205000     -0.9446000    
 C    1.970600      -1.177700     -0.2892000    
 C    1.818900       1.365300     -0.3105000    
 C   -5.089100     -0.1358000      -1.423600    
 C   0.3855000      -2.479000       1.004600    
 C   8.9699998E-02   2.489600      0.9650000    
 C    2.782700      -2.316700     -0.4093000    
 C    2.487000       2.591700     -0.4543000    
 C    1.206600      -3.601900      0.8841000    
 C   0.7697000       3.700800      0.8223000    
 C    2.401000      -3.522300      0.1746000    
 C    1.963700       3.753100      0.1097000    
 H   -1.961400       1.918100      3.5700001E-02
 H   -2.327400       1.471600       1.769500    
 H   -2.594100      -1.579100       1.557400    
 H   -1.622500      -2.296800      0.2662000    
 H   -4.285300      0.4307000       1.150100    
 H   -4.194100       1.813500      6.4000003E-02
 H   -2.847300      -1.832900      -1.429300    
 H   -4.045600      -2.048600     -0.1573000    
 H    3.498000      0.1837000     -0.8782000    
 H   -5.423300      0.8505000      -1.763800    
 H   -5.827100     -0.5220000     -0.7114000    
 H   -5.084200     -0.7871000      -2.304700    
 H  -0.4162000      -2.567700       1.733400    
 H  -0.7170000       2.526600       1.681700    
 H    3.720400      -2.266200     -0.9572000    
 H    3.423500       2.645200      -1.004000    
 H   0.9343000      -4.528100       1.382300    
 H   0.3870000       4.597500       1.301600    
 H    3.041700      -4.394900      8.8299997E-02
 H    2.494000       4.694900      4.9999999E-03
 H    2.194400       1.018000      -2.684400    


%chk=000035758-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000035758

0 1
O 1.073265 -0.061140 -2.389380
N -3.740279 -0.010454 -0.942985
C -1.495651 -0.114960 0.704797
C -2.418806 1.100081 0.810048
C -2.276826 -1.410612 0.564884
C -0.120253 -0.030647 0.625375
C -3.844236 0.790075 0.290217
C -3.194521 -1.369030 -0.694969
C 0.780505 -1.222350 0.523921
C 0.624628 1.262410 0.507410
C 2.025240 0.072787 -1.241315
C 1.870953 -1.172664 -0.393260
C 1.718814 1.309511 -0.413616
C -4.944914 -0.028142 -1.783338
C 0.663695 -2.355681 1.370903
C 0.353340 2.419816 1.282680
C 2.781925 -2.245221 -0.483529
C 2.486950 2.485871 -0.556278
C 1.574853 -3.430800 1.275248
C 1.123110 3.595728 1.133240
C 2.633484 -3.384756 0.339234
C 2.189901 3.637646 0.207559
H -1.999715 1.943829 0.232961
H -2.492925 1.436501 1.866536
H -2.910450 -1.556506 1.464196
H -1.623183 -2.290781 0.479601
H -4.455502 0.284422 1.083910
H -4.359752 1.739732 0.055983
H -2.615762 -1.683994 -1.584097
H -4.017077 -2.115512 -0.547354
H 3.052193 0.138147 -1.656308
H -5.255045 1.005018 -2.022495
H -5.814686 -0.553101 -1.309043
H -4.723640 -0.544821 -2.735436
H -0.117282 -2.375650 2.138660
H -0.435715 2.392451 2.039307
H 3.607304 -2.188324 -1.203204
H 3.323859 2.497427 -1.265886
H 1.469772 -4.293277 1.943180
H 0.898384 4.472441 1.751130
H 3.342322 -4.216643 0.265009
H 2.791069 4.546349 0.094980
H 0.818656 0.851919 -2.683479


