%chk=000121327.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121327

0 1
 O  -0.3714000     -0.1076000     -0.7949000    
 N   -3.920700     -0.2541000      0.2899000    
 C   -1.651300      0.4080000     -0.4451000    
 C   -2.235500       1.121400      -1.660300    
 C   -2.561000     -0.7350000      1.4700000E-02
 C   -3.673000       1.546000      -1.390400    
 C   -4.516200      0.3670000     -0.9015000    
 C   0.5044000     -0.1289000      0.3345000    
 C   -4.763200      -1.348000      0.7725000    
 C    1.401300      -1.347600      0.2324000    
 C    1.200600       1.200300      0.5375000    
 C    2.583300      -1.430800     -0.5329000    
 C    2.080200       1.721000     -0.4266000    
 C    3.219000     -0.3148000      -1.337400    
 C    2.402800      0.9316000      -1.665500    
 C   -6.132800     -0.8221000       1.156600    
 C   0.9698000      -2.497800      0.9334000    
 C   0.9478000       1.945100       1.701800    
 C    3.301700      -2.649100     -0.5352000    
 C    2.685000       2.969600     -0.2132000    
 C    1.690200      -3.690500      0.9068000    
 C    1.554800       3.184400       1.904400    
 C    2.862100      -3.765700      0.1726000    
 C    2.422100       3.697400      0.9460000    
 H   -1.570600       1.154100      0.3575000    
 H   -2.198000      0.4587000      -2.534700    
 H   -1.620300       1.991800      -1.918000    
 H   -2.565800      -1.532000     -0.7420000    
 H   -2.140900      -1.185100      0.9217000    
 H   -3.683700       2.344600     -0.6377000    
 H   -4.112300       1.962200      -2.304100    
 H   -5.507100      0.7800000     -0.6894000    
 H   -4.629800     -0.3662000      -1.711000    
 H  -9.6900001E-02 -0.2910000       1.240500    
 H   -4.863000      -2.149400      2.9800000E-02
 H   -4.307800      -1.787200       1.668500    
 H    4.134900     -1.2400000E-02 -0.8109000    
 H    3.534300     -0.7414000      -2.299800    
 H    1.488200      0.6801000      -2.212700    
 H    2.987900       1.555700      -2.353600    
 H   -6.067200      7.9599999E-02   1.775300    
 H   -6.763400     -0.6136000      0.2870000    
 H   -6.661100      -1.580500       1.745800    
 H   5.0700001E-02  -2.472400       1.516100    
 H   0.2689000       1.566900       2.462500    
 H    4.227200      -2.730700      -1.102900    
 H    3.372300       3.381200     -0.9482000    
 H    1.333800      -4.554700       1.459100    
 H    1.348300       3.748600       2.809100    
 H    3.434700      -4.687700      0.1470000    
 H    2.896400       4.661900       1.101500    


%chk=000121327-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121327

0 1
O -0.336504 -0.308503 -0.799816
N -3.980512 -0.079749 0.217611
C -1.651520 0.331865 -0.567876
C -2.170134 0.799875 -1.934256
C -2.632940 -0.683482 0.060580
C -3.611569 1.342719 -1.795751
C -4.531195 0.315143 -1.104494
C 0.559781 -0.320647 0.404105
C -4.888800 -0.964932 0.993147
C 1.544520 -1.471031 0.198706
C 1.143262 1.064425 0.663502
C 2.738053 -1.417248 -0.581929
C 1.948622 1.718234 -0.312542
C 3.283117 -0.192202 -1.323055
C 2.322469 0.991941 -1.591261
C -6.181778 -0.266158 1.453301
C 1.196502 -2.694093 0.835278
C 0.839095 1.727881 1.875855
C 3.529177 -2.595843 -0.679026
C 2.422768 3.023836 -0.045044
C 1.990874 -3.851321 0.729508
C 1.324616 3.029418 2.138769
C 3.176506 -3.798880 -0.037981
C 2.117834 3.682015 1.169881
H -1.542774 1.202114 0.111940
H -2.152041 -0.065143 -2.627168
H -1.493044 1.569053 -2.348150
H -2.648146 -1.595735 -0.590968
H -2.271897 -0.993625 1.059970
H -3.605680 2.272925 -1.195631
H -4.021032 1.591230 -2.793389
H -5.532716 0.755263 -0.957278
H -4.650477 -0.582337 -1.769960
H -0.062385 -0.586136 1.284371
H -5.149117 -1.890379 0.414625
H -4.328927 -1.298374 1.888294
H 4.159380 0.190619 -0.758609
H 3.677860 -0.542873 -2.296936
H 1.411397 0.612100 -2.087780
H 2.823168 1.694881 -2.283138
H -5.938428 0.668881 1.988059
H -6.849315 -0.018387 0.608975
H -6.746790 -0.926184 2.137071
H 0.271283 -2.731590 1.423993
H 0.216726 1.219534 2.623637
H 4.446942 -2.558687 -1.280363
H 3.040984 3.529420 -0.797274
H 1.691892 -4.776512 1.234022
H 1.081042 3.527966 3.083459
H 3.814263 -4.684276 -0.138875
H 2.495287 4.693888 1.356390


