%chk=000103513.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000103513

0 1
 P    1.390400      0.3761000     -0.8651000    
 O    1.884300     -9.1899998E-02  -2.212200    
 N   -3.099800     -0.2153000      3.7799999E-02
 C  -0.2149000     -0.4567000     -0.5999000    
 C   -1.281800      3.5599999E-02  -1.592500    
 C   -2.656000     -0.5731000      -1.309300    
 C   -4.366700     -0.8882000      0.3573000    
 C   -3.225800       1.243200      0.1668000    
 C   -4.820100     -0.5635000       1.781600    
 C   -3.641900       1.637700       1.584700    
 C   -4.933700      0.9412000       1.997700    
 C  -9.3699999E-02  -1.966600     -0.6510000    
 C    1.062400       2.118300     -0.7732000    
 C    2.483000     -5.0299998E-02  0.4656000    
 C   0.2816000      -2.650900      0.4907000    
 C  -0.3618000      -2.623900      -1.837900    
 C   0.4660000       2.647900      0.3659000    
 C    2.088400      0.1722000       1.781000    
 C    1.405200       2.940400      -1.840900    
 C    3.727400     -0.6053000      0.1852000    
 C   0.3931000      -4.040500      0.4440000    
 C  -0.2505000      -4.013600      -1.884600    
 C   0.2090000       4.017000      0.4381000    
 C    2.947700     -0.1636000       2.827200    
 C    1.148100       4.309600      -1.768600    
 C    4.586500     -0.9411000       1.231600    
 C   0.1270000      -4.721900     -0.7436000    
 C   0.5500000       4.847800     -0.6290000    
 C    4.196600     -0.7203000       2.552500    
 H  -0.5372000     -0.1789000      0.4104000    
 H   -1.325300       1.127700      -1.597800    
 H  -0.9935000     -0.1728000      -2.629400    
 H   -3.364200     -0.1941000      -2.058900    
 H   -2.659300      -1.659600      -1.427100    
 H   -4.240000      -1.975000      0.2815000    
 H   -5.152300     -0.6005000     -0.3537000    
 H   -3.953200       1.639900     -0.5536000    
 H   -2.281400       1.761400     -2.4999999E-03
 H   -4.103600     -0.9828000       2.499500    
 H   -5.787000      -1.039500       1.980000    
 H   -3.773900       2.724100       1.643900    
 H   -2.842700       1.373800       2.289200    
 H   -5.157100       1.154900       3.048600    
 H   -5.767600       1.334400       1.403600    
 H   0.4697000      -2.139500       1.428200    
 H  -0.6167000      -2.129300      -2.766500    
 H   0.1252000       2.031900       1.185000    
 H    1.105600      0.5377000       2.040000    
 H    1.871800       2.532700      -2.732100    
 H    4.042800     -0.7814000     -0.8383000    
 H   0.6825000      -4.592400       1.333500    
 H  -0.4483000      -4.544400      -2.811400    
 H  -0.2718000       4.433800       1.318300    
 H    2.638200     -6.6999998E-03   3.856400    
 H    1.412800       4.956400      -2.599900    
 H    5.558700      -1.375500       1.017900    
 H   0.2148000      -5.803800     -0.7804000    
 H   0.3462000       5.913200     -0.5745000    
 H    4.864100     -0.9855000       3.367200    


%chk=000103513-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000103513

0 1
P 1.331528 0.379080 -0.970740
O 1.960684 0.165211 -2.452405
N -3.195925 -0.025366 0.008655
C -0.300348 -0.557034 -0.651537
C -1.348067 -0.123774 -1.712376
C -2.770420 -0.572844 -1.306652
C -4.295132 -0.820276 0.618053
C -3.551139 1.416877 -0.058450
C -4.614525 -0.327208 2.043957
C -3.851516 1.984634 1.344161
C -4.972253 1.176725 2.036799
C -0.074938 -2.060727 -0.615176
C 0.931002 2.192970 -0.685463
C 2.542844 -0.152627 0.356175
C -0.527930 -2.823933 0.490758
C 0.554579 -2.728808 -1.700517
C 0.187835 2.662872 0.423020
C 2.225218 -0.163187 1.733924
C 1.418438 3.099357 -1.655630
C 3.824015 -0.551993 -0.088037
C -0.362104 -4.227349 0.515703
C 0.723277 -4.130280 -1.672615
C -0.062328 4.047134 0.562542
C 3.198882 -0.571954 2.672710
C 1.168922 4.482754 -1.510739
C 4.795122 -0.959244 0.854200
C 0.263407 -4.885570 -0.567928
C 0.430475 4.957838 -0.401614
C 4.484422 -0.967707 2.233844
H -0.675124 -0.217002 0.333377
H -1.320747 0.974301 -1.848354
H -1.094917 -0.567579 -2.692835
H -3.483961 -0.288311 -2.120693
H -2.786840 -1.676184 -1.232532
H -3.981724 -1.880842 0.641738
H -5.228189 -0.761891 -0.003386
H -4.447572 1.571277 -0.717084
H -2.711915 1.972179 -0.513528
H -3.727719 -0.493097 2.686872
H -5.447411 -0.925027 2.461715
H -4.134903 3.051147 1.254849
H -2.928204 1.933840 1.955225
H -5.136568 1.542766 3.068060
H -5.924174 1.324391 1.485778
H -1.017076 -2.312964 1.329793
H 0.935374 -2.138749 -2.543301
H -0.207581 1.966896 1.172744
H 1.229396 0.132742 2.085163
H 1.977303 2.700946 -2.510858
H 4.032528 -0.542343 -1.164486
H -0.717694 -4.804285 1.377242
H 1.218841 -4.634052 -2.510486
H -0.639731 4.412323 1.419309
H 2.955735 -0.584289 3.740957
H 1.547321 5.186781 -2.260092
H 5.788719 -1.270887 0.513596
H 0.394781 -5.973509 -0.550200
H 0.237312 6.030793 -0.290029
H 5.238015 -1.284446 2.963825


