%chk=000125786.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125786

1 1
 P  -0.5971000       2.465100      0.2229000    
 O   -1.462700       1.262000      0.8703000    
 O   0.3785000       1.763500     -0.8564000    
 O   -1.659900       3.250500     -0.7138000    
 O   9.4999999E-02   3.352900       1.217700    
 N   -3.603900      -1.657200     -3.4499999E-02
 N    4.556000      -1.668800      0.3935000    
 N    4.144000      -2.847500      0.4217000    
 C   -2.889000     -0.6685000      0.8752000    
 C   -2.589100      -2.336600     -0.9425000    
 C   -4.309600      -2.706700      0.8124000    
 C   -4.628200     -0.9174000     -0.8827000    
 C   -2.162300      0.3565000      2.7100001E-02
 C    1.409400      0.9169000     -0.5479000    
 C    1.673900      0.6087000      0.7824000    
 C    2.183100      0.3725000      -1.567600    
 C    2.724400     -0.2535000       1.096700    
 C    3.233500     -0.4898000      -1.253200    
 C    3.504100     -0.8027000      7.9000004E-02
 H   -3.632500     -0.1951000       1.527500    
 H   -2.189900      -1.226200       1.510100    
 H   -1.753500      -2.693800     -0.3333000    
 H   -3.084800      -3.184900      -1.426000    
 H   -2.252900      -1.646400      -1.720100    
 H   -5.030200      -2.199200       1.460400    
 H   -4.822800      -3.407400      0.1471000    
 H   -3.557600      -3.230100       1.410400    
 H   -5.247500     -0.2988000     -0.2264000    
 H   -4.125900     -0.3133000      -1.642000    
 H   -5.250500      -1.663900      -1.387000    
 H   -1.420800     -9.9500000E-02 -0.6299000    
 H   -2.851200      0.9521000     -0.5753000    
 H   -2.275100       3.890900     -0.2970000    
 H    1.092200       1.006100       1.605900    
 H    1.975600      0.6136000      -2.606300    
 H    2.927100     -0.4923000       2.137600    
 H    3.835500     -0.9122000      -2.053600    
 H    4.899600      -3.502800      0.6509000    


%chk=000125786-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125786

1 1
P -0.690388 2.875479 0.509235
O -2.022400 1.852034 0.936441
O 0.214863 1.866163 -0.602096
O -1.431669 3.866948 -0.655141
O 0.039820 3.496314 1.757910
N -2.994684 -1.559434 -0.447047
N 3.320785 -2.733012 0.556647
N 3.581980 -3.010170 1.797983
C -2.442252 -0.420760 0.440551
C -2.340249 -1.532211 -1.830275
C -2.648496 -2.886816 0.235679
C -4.512712 -1.451351 -0.587712
C -2.686344 1.011447 -0.077769
C 0.998394 0.745471 -0.200737
C 1.381002 0.494510 1.141872
C 1.391757 -0.105488 -1.258925
C 2.142995 -0.654036 1.425886
C 2.166266 -1.244873 -0.961957
C 2.528160 -1.533681 0.377747
H -2.908716 -0.531628 1.434201
H -1.357273 -0.593146 0.540642
H -1.246014 -1.507122 -1.707121
H -2.639022 -2.437647 -2.380213
H -2.675752 -0.641832 -2.381348
H -3.102043 -2.904613 1.238227
H -3.044183 -3.716460 -0.369813
H -1.554394 -2.972097 0.319469
H -4.967244 -1.443753 0.414806
H -4.769099 -0.525463 -1.122165
H -4.880382 -2.318274 -1.157849
H -2.258921 1.184876 -1.081377
H -3.750238 1.299337 -0.068889
H -1.011829 4.746542 -0.834898
H 1.122326 1.199224 1.940378
H 1.128904 0.159433 -2.287587
H 2.466776 -0.879439 2.447259
H 2.516516 -1.916377 -1.752632
H 4.168659 -3.881397 1.803918


