%chk=000139656.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000139656

0 1
 P   0.1921000      0.1199000      0.2732000    
 N  -0.1657000     -0.1215000       1.822000    
 C   -1.501200     -0.6402000       2.149900    
 C    1.844100      0.7404000      0.1696000    
 C   -1.069900       1.185500     -0.3581000    
 C   0.1579000      -1.485700     -0.4802000    
 C   -1.978900      -1.511200      0.9885000    
 C   -1.381500      -1.467700       3.429200    
 C   -2.441000      0.5461000       2.362500    
 C    2.198200       1.610100     -0.8609000    
 C   -1.252600       2.451800      0.1951000    
 C   0.4012000      -2.616300      0.2931000    
 C    2.791100      0.3597000       1.119500    
 C   -1.879900      0.7572000      -1.408800    
 C  -0.1132000      -1.603900      -1.839600    
 C    3.501700       2.099900     -0.9421000    
 C   -2.248000       3.292100     -0.3034000    
 C   0.3737000      -3.878600     -0.2995000    
 C    4.094600      0.8497000       1.038300    
 C   -2.875100       1.597800      -1.907300    
 C  -0.1408000      -2.866400      -2.432000    
 C    4.449800       1.719700      7.4999998E-03
 C   -3.059100       2.865300      -1.354600    
 C   0.1027000      -4.003700      -1.661900    
 H   -1.690000      -2.559400       1.059900    
 H   -3.054900      -1.654200       1.208300    
 H   -2.086500      -1.132600     -8.8999998E-03
 H   -1.032900     -0.8487000       4.264000    
 H  -0.6623000      -2.285900       3.315200    
 H   -2.344900      -1.905400       3.712900    
 H   -2.936300      0.8761000       1.448600    
 H   -3.262100      0.2623000       3.033200    
 H   -1.931200       1.395400       2.829800    
 H    1.471500       1.907700      -1.610700    
 H  -0.6211000       2.793400       1.010200    
 H   0.6699000      -2.542000       1.342000    
 H    2.530500     -0.3219000       1.923600    
 H   -1.897900     -0.2185000      -1.854100    
 H  -0.1390000     -0.7438000      -2.500300    
 H    3.778800       2.775800      -1.745800    
 H   -2.391300       4.278800      0.1272000    
 H   0.5778000      -4.763000      0.2969000    
 H    4.833500      0.5524000       1.776700    
 H   -3.521600       1.260000      -2.712300    
 H  -0.3127000      -2.961800      -3.500200    
 H    5.464900       2.100400     -5.6100000E-02
 H   -3.837300       3.517800      -1.739700    
 H   9.3300000E-02  -4.985700      -2.125700    


%chk=000139656-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000139656

0 1
P -0.018044 -0.110105 0.324750
N -0.255983 -0.479561 1.944729
C -1.585402 -0.763551 2.578370
C 1.692877 0.648928 0.299605
C -1.126386 1.124518 -0.590712
C 0.114002 -1.591543 -0.865689
C -2.459027 -1.785940 1.798063
C -1.222446 -1.359370 3.964572
C -2.390195 0.552339 2.787230
C 2.295186 1.061960 -0.911495
C -0.877033 2.512080 -0.446763
C 0.375106 -2.848908 -0.273397
C 2.375190 0.794629 1.527617
C -2.277413 0.690251 -1.295113
C 0.035454 -1.475271 -2.274054
C 3.587999 1.633079 -0.889920
C -1.760828 3.454973 -1.017163
C 0.550845 -3.991009 -1.085807
C 3.669544 1.361065 1.543545
C -3.161386 1.635237 -1.862697
C 0.209686 -2.620291 -3.085556
C 4.276829 1.782428 0.336828
C -2.905244 3.019434 -1.725677
C 0.467136 -3.878843 -2.493597
H -1.907819 -2.729803 1.638015
H -3.387391 -2.015971 2.355286
H -2.752017 -1.384199 0.808971
H -0.584354 -0.651648 4.522617
H -0.659346 -2.301747 3.841445
H -2.134680 -1.560337 4.557355
H -2.679299 0.999805 1.818810
H -3.312536 0.366864 3.371494
H -1.768097 1.284714 3.331987
H 1.768652 0.947062 -1.865987
H 0.004674 2.854463 0.106786
H 0.445032 -2.912378 0.820029
H 1.863929 0.456763 2.436321
H -2.484665 -0.380290 -1.407834
H -0.169434 -0.505893 -2.742750
H 4.055718 1.956634 -1.826422
H -1.557799 4.526034 -0.906656
H 0.754117 -4.963815 -0.624098
H 4.202838 1.472895 2.494282
H -4.047606 1.291302 -2.407696
H 0.145680 -2.529529 -4.175896
H 5.280674 2.222322 0.351140
H -3.591171 3.752014 -2.165616
H 0.602833 -4.764592 -3.124554


