%chk=000123729.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000123729

0 1
 P    3.486500      -1.335600      0.8742000    
 P    4.325900       1.404200      0.2094000    
 O  -0.8140000      -1.929000      0.9181000    
 O   -2.673000      -4.090400     -0.5536000    
 O  -0.7071000      -3.455800      -2.332600    
 O    2.007400      -1.989000      0.8078000    
 O    3.264500      0.2142000      0.4714000    
 O    4.255200      -1.946300     -0.4117000    
 O    4.204600      -1.535800       2.177200    
 O    3.387600       2.706700      2.1199999E-02
 O    4.994000       1.626500       1.664200    
 O    5.294500       1.144900     -0.9066000    
 N   -2.860900     -0.7372000      0.7620000    
 N   -4.416800      0.8017000       1.197500    
 N   -1.083600      0.6948000     -7.0299998E-02
 N   -1.754500       3.041200     -5.8300000E-02
 N   -3.910000       3.757300      0.6956000    
 N   0.3509000       2.375300     -0.7980000    
 N   0.3729000       2.388300      -2.048500    
 N   0.3870000       2.398300      -3.189700    
 C   -2.389200      -2.702200     -0.7192000    
 C   -1.026600      -2.491800      -1.352300    
 C   -2.228400      -2.053100      0.6565000    
 C  -9.8300003E-02  -2.566600     -0.1525000    
 C    1.230800      -1.866400     -0.3710000    
 C   -2.309700      0.4673000      0.4244000    
 C   -4.127700     -0.4827000       1.220600    
 C   -3.289300       1.407200      0.7021000    
 C   -2.976100       2.737700      0.4428000    
 C  -0.8968000       2.016000     -0.2805000    
 H   -3.195800      -2.278700      -1.326200    
 H  -0.9913000      -1.496400      -1.810800    
 H   -2.654400      -2.667300       1.458700    
 H   8.4399998E-02  -3.606300      0.1486000    
 H    1.085900     -0.8031000     -0.5796000    
 H    1.771700      -2.319900      -1.207100    
 H   -3.535400      -4.159100     -0.1094000    
 H   0.1915000      -3.267200      -2.652000    
 H   -4.789700      -1.269900       1.554600    
 H   -4.822000       3.533300       1.069900    
 H   -3.658600       4.716600      0.4992000    
 H    4.626200      -2.852600     -0.3561000    
 H    3.802500       3.558600     -0.2324000    
 H    5.745000       2.251500       1.751400    


%chk=000123729-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000123729

0 1
P 2.024004 -0.772633 1.669956
P 2.576197 1.782985 -0.157105
O -0.625832 -2.493013 0.755908
O -2.961100 -4.031990 -0.829758
O -0.945815 -3.911617 -2.514811
O 2.160485 -1.984523 0.449078
O 1.567766 0.674212 0.886528
O 3.727614 -0.379182 1.849277
O 1.306580 -1.113371 3.030492
O 1.713978 3.204205 -0.034744
O 3.944943 2.036773 0.798381
O 2.734875 1.131377 -1.595207
N -2.356111 -0.860171 0.898967
N -2.486118 0.900303 2.378221
N -1.409426 0.335462 -1.057506
N -0.711456 2.607141 -0.459136
N -1.130493 3.559391 1.667371
N -0.412214 1.685791 -2.670270
N 0.120732 2.783700 -3.036368
N 0.628150 3.694174 -3.586938
C -2.396897 -2.691179 -0.897356
C -1.014449 -2.728008 -1.640877
C -2.067121 -2.262786 0.551047
C 0.037133 -2.881386 -0.512969
C 1.255250 -1.976541 -0.733271
C -1.884945 0.264822 0.218281
C -2.692577 -0.412371 2.196776
C -1.960569 1.330128 1.148429
C -1.290422 2.532832 0.793007
C -0.872826 1.544307 -1.338222
H -3.107604 -1.999075 -1.384938
H -0.876023 -1.790261 -2.204566
H -2.631082 -2.898652 1.253428
H 0.341355 -3.940143 -0.426533
H 0.958686 -0.939966 -0.970462
H 1.878631 -2.371215 -1.552908
H -2.476045 -4.574708 -1.516936
H -1.098894 -3.650620 -3.456206
H -3.060907 -1.098151 2.956580
H -1.463881 3.440488 2.623750
H -0.541745 4.357871 1.432677
H 4.297841 -1.066220 2.271187
H 0.667729 3.114975 -0.341673
H 4.192401 1.186042 1.298419


