%chk=000111593.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000111593

1 1
 N   0.4162000      0.7333000      0.6198000    
 C    1.332300     -0.2192000      0.3619000    
 C  -0.7873000      0.4063000       1.402200    
 C   0.5388000       1.997800      0.1948000    
 C    2.479000      0.1194000     -0.3902000    
 C   -1.910300     -4.6900000E-02  0.5101000    
 C    1.642700       2.385000     -0.5464000    
 C    2.618800       1.439100     -0.8405000    
 C    1.153000      -1.524300      0.8310000    
 C  -0.5191000       2.999000      0.5219000    
 C    3.432000     -0.8760000     -0.6574000    
 C    2.110300      -2.500000      0.5560000    
 C   -1.712400     -0.1066000     -0.8631000    
 C   -3.130800     -0.3995000       1.070600    
 C    3.246200      -2.177300     -0.1858000    
 C   -2.753700     -0.5268000      -1.690500    
 C   -4.172100     -0.8197000      0.2431000    
 C   -3.983600     -0.8834000      -1.137500    
 H   -1.104800       1.269700       1.993700    
 H  -0.5573000     -0.3289000       2.177300    
 H    1.760700       3.405000     -0.8986000    
 H    3.487900       1.737600      -1.422100    
 H   0.2875000      -1.867000       1.384100    
 H  -0.4950000       3.258600       1.585000    
 H  -0.3474000       3.933600     -2.6100000E-02
 H   -1.519300       2.669700      0.2305000    
 H    4.325200     -0.6467000      -1.234300    
 H    1.968500      -3.516100      0.9132000    
 H  -0.7852000      0.1553000      -1.357800    
 H   -3.285100     -0.3525000       2.144900    
 H    3.988600      -2.941200     -0.3992000    
 H   -2.607900     -0.5766000      -2.765700    
 H   -5.129800      -1.097300      0.6738000    
 H   -4.794400      -1.210500      -1.781800    


%chk=000111593-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000111593

1 1
N 0.409378 0.828837 0.583066
C 1.344150 -0.204020 0.331120
C -0.844273 0.486390 1.330229
C 0.625022 2.125212 0.175935
C 2.609597 0.139239 -0.274714
C -1.973517 -0.070053 0.460017
C 1.857776 2.460993 -0.450116
C 2.844960 1.495599 -0.650528
C 1.065019 -1.562399 0.655669
C -0.427437 3.180949 0.400631
C 3.582212 -0.887583 -0.499518
C 2.036401 -2.543276 0.413702
C -1.912610 -0.095740 -0.953555
C -3.134570 -0.549779 1.118527
C 3.304626 -2.210253 -0.152965
C -3.003616 -0.597609 -1.701989
C -4.221632 -1.048983 0.369701
C -4.159078 -1.073885 -1.043914
H -1.178178 1.399209 1.849750
H -0.567315 -0.228281 2.124107
H 2.013518 3.496001 -0.759980
H 3.800540 1.769425 -1.109900
H 0.094984 -1.865222 1.054075
H -0.474158 3.495669 1.461150
H -0.182622 4.076954 -0.189963
H -1.433900 2.841133 0.101110
H 4.542158 -0.618079 -0.952097
H 1.812978 -3.586647 0.656887
H -1.025342 0.263621 -1.487930
H -3.194850 -0.534038 2.214219
H 4.047153 -2.995164 -0.322905
H -2.949013 -0.616332 -2.795355
H -5.113662 -1.417340 0.886507
H -5.002500 -1.461648 -1.624074


