%chk=000086797.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086797

0 1
 P    2.368400      5.3700000E-02 -0.1246000    
 O    1.922300       1.310600      0.7782000    
 O    2.003000      -1.254100      0.7580000    
 O    3.986300      8.0799997E-02 -8.6300001E-02
 O    1.788100      5.4499999E-02  -1.509900    
 N   -4.419200       1.891400     -0.8552000    
 N   -3.426800      -3.197000       1.185400    
 C    1.835800       2.612900      0.1838000    
 C    2.002500      -2.519900      0.1205000    
 C   0.5086000       2.673100     -0.5996000    
 C   0.6527000      -2.665300     -0.6113000    
 C  -0.7496000       2.339700      0.2081000    
 C  -0.5819000      -2.245700      0.1928000    
 C   -1.997400       2.359300     -0.6857000    
 C   -1.869000      -2.500600     -0.6038000    
 C    1.895800       3.642200       1.314200    
 C    3.054400       2.756400     -0.7288000    
 C    2.178300      -3.563100       1.224600    
 C    3.194900      -2.555700     -0.8375000    
 C   -3.280600       1.958800      6.1700001E-02
 C   -3.144300      -2.164400      0.1875000    
 C   -3.582900       2.953400       1.182100    
 C   -4.339300      -2.020900     -0.7542000    
 H   0.5401000       2.012500      -1.469800    
 H   0.3990000       3.684900      -1.013500    
 H   0.5413000      -3.710400     -0.9302000    
 H   0.6598000      -2.083100      -1.539200    
 H  -0.6519000       1.350400      0.6685000    
 H  -0.8579000       3.070900       1.014100    
 H  -0.6135000      -2.806000       1.132300    
 H  -0.5251000      -1.182000      0.4491000    
 H   -2.114900       3.357500      -1.127400    
 H   -1.841600       1.662600      -1.520300    
 H   -1.833100      -1.882900      -1.510700    
 H   -1.902200      -3.544600     -0.9421000    
 H    1.130500       3.450200       2.073400    
 H    2.857100       3.584400       1.838300    
 H    1.770300       4.661800      0.9364000    
 H    3.113000       3.785100      -1.105500    
 H    3.987900       2.562300     -0.1900000    
 H    3.032100       2.120400      -1.616300    
 H    2.148900      -4.581100      0.8232000    
 H    1.404800      -3.469100       1.994100    
 H    3.135400      -3.424100       1.741000    
 H    3.111900      -1.898400      -1.704600    
 H    3.293000      -3.566900      -1.253200    
 H    4.136100      -2.343100     -0.3204000    
 H   -3.142600      0.9698000      0.5068000    
 H   -3.004400      -1.214500      0.7118000    
 H   -3.630200       3.981800      0.8073000    
 H   -2.830300       2.909200       1.975000    
 H   -4.545800       2.725700       1.654600    
 H   -4.539600      -2.954800      -1.291600    
 H   -4.156500      -1.238400      -1.497900    
 H   -5.244700      -1.747000     -0.2012000    
 H   -4.230400       1.207000      -1.586300    
 H   -5.243200       1.559300     -0.3558000    
 H   -2.672000      -3.236400       1.868200    
 H   -4.268400      -2.950500       1.705000    
 H    4.491900     -0.1657000     -0.8898000    


%chk=000086797-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000086797

0 1
P 2.491938 0.050814 -0.482065
O 2.121343 1.330629 0.578620
O 2.131499 -1.193290 0.627950
O 4.234931 0.082500 -0.553006
O 1.852762 0.009213 -1.946067
N -4.400496 1.684913 -0.470476
N -3.473625 -3.071453 1.004964
C 1.880407 2.754319 0.077249
C 2.019542 -2.655086 0.200010
C 0.481455 2.811643 -0.587645
C 0.705565 -2.842925 -0.601190
C -0.703450 2.452339 0.334477
C -0.593316 -2.495621 0.158255
C -2.024081 2.320801 -0.455677
C -1.825374 -2.539777 -0.773980
C 1.976065 3.557964 1.383455
C 2.986523 3.162479 -0.916860
C 2.021037 -3.372158 1.559139
C 3.244935 -3.054151 -0.647077
C -3.262025 2.011391 0.421814
C -3.152821 -2.129491 -0.093646
C -3.668484 3.204497 1.311358
C -4.317286 -2.146750 -1.104591
H 0.490703 2.131397 -1.462331
H 0.342691 3.838291 -0.984944
H 0.666840 -3.901218 -0.932183
H 0.769746 -2.222551 -1.516691
H -0.483381 1.499139 0.855667
H -0.815114 3.226086 1.118574
H -0.733354 -3.210515 0.993162
H -0.495978 -1.484683 0.603244
H -2.231285 3.246506 -1.029550
H -1.906460 1.508694 -1.205367
H -1.647503 -1.859116 -1.631829
H -1.950657 -3.563305 -1.181263
H 1.304525 3.138205 2.149343
H 3.006347 3.529643 1.776419
H 1.691043 4.610157 1.199851
H 2.899771 4.241335 -1.139848
H 3.985081 2.974765 -0.486456
H 2.891465 2.612776 -1.871348
H 1.808303 -4.447650 1.418313
H 1.255331 -2.944350 2.225681
H 3.002883 -3.262627 2.049840
H 3.210167 -2.586965 -1.648862
H 3.253357 -4.149944 -0.789267
H 4.180009 -2.759078 -0.141337
H -2.987492 1.158968 1.096726
H -3.028144 -1.077085 0.273195
H -3.902688 4.079834 0.678651
H -2.863567 3.475502 2.017031
H -4.568024 2.963876 1.910701
H -4.457967 -3.170405 -1.495901
H -4.113216 -1.471274 -1.956076
H -5.266724 -1.825788 -0.633596
H -4.209752 0.912290 -1.119019
H -5.291596 1.555441 0.021791
H -2.766981 -3.109006 1.746300
H -4.416638 -2.950527 1.389441
H 4.556115 0.017284 -1.489774


