%chk=000131365.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131365

0 1
 P   -3.772400      0.7823000       1.570900    
 O    1.700400       1.118400     -0.9083000    
 O    3.265100      -1.960200      8.8900000E-02
 O   0.4005000       2.056400      0.8323000    
 O    4.313800      0.5166000      -1.347500    
 O    1.478500       4.021700      -1.960000    
 O   0.4588000       5.032100      0.3571000    
 O    4.811200      -2.379800       2.390300    
 O   -2.232300       1.223400       1.340700    
 O   -3.329900      -3.402900      0.2803000    
 O   -4.522900       2.197300       1.793500    
 O   -4.265600      0.3272000      9.9500000E-02
 O   -3.986900     -0.2272000       2.660400    
 N   0.8996000      -1.840500     -5.5900000E-02
 N  -0.5584000      -1.465300      -1.966400    
 N  -0.5840000      -2.919000       1.239200    
 N   -2.783600      -2.327700      -1.699000    
 N   -2.107100      -1.215300      -3.663800    
 C    2.329400      0.2124000     -2.5100000E-02
 C    3.839300      0.3479000     -1.1700000E-02
 C    2.159000      -1.230300     -0.4759000    
 C    4.283900      -1.019000      0.4992000    
 C    1.318700       2.313500     -0.2430000    
 C   0.5838000       3.220200      -1.214900    
 C  -0.3090000       4.019600     -0.2920000    
 C  -0.7136000       2.970900      0.7362000    
 C    4.406300      -1.074800       2.015500    
 C   -1.946000       2.174600      0.3285000    
 C  -0.2631000      -1.917200     -0.7448000    
 C   0.6548000      -2.465300       1.147200    
 C   -1.158400      -2.573400      4.8500001E-02
 C   -2.510200      -2.815200     -0.4149000    
 C   -1.859800      -1.701700      -2.404900    
 H    1.950700      0.3051000       1.001400    
 H    4.207900       1.188500      0.5829000    
 H    2.214700      -1.331500      -1.566500    
 H    5.220700      -1.348200      3.5399999E-02
 H    2.211600       2.805400      0.1633000    
 H  -9.9999998E-03   2.625000      -1.919000    
 H   -1.150500       4.504700     -0.7945000    
 H  -0.8570000       3.401800       1.733500    
 H    3.454700     -0.8666000       2.514500    
 H    5.155600     -0.3644000       2.376700    
 H   -1.770600       1.615000     -0.5960000    
 H   -2.792900       2.849200      0.1713000    
 H    3.925900       1.340400      -1.689200    
 H    1.409000      -2.555600       1.917000    
 H   0.9446000       4.636100      -2.491900    
 H   0.7947000       5.627900     -0.3342000    
 H   0.1027000     -0.9719000      -2.557300    
 H    4.139300      -3.001100       2.061100    
 H   -3.017300      -1.322000      -4.098100    
 H   -1.389900     -0.7346000      -4.195700    
 H   -5.470500       2.197200       2.046800    
 H   -5.163200     -5.4699998E-02 -3.1999999E-03


%chk=000131365-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000131365

0 1
P -3.844125 0.747713 1.817676
O 1.684919 1.731803 -0.549743
O 2.729270 -1.767274 -0.556069
O 0.503385 2.428966 1.440384
O 4.067729 0.900166 -1.644025
O 1.817884 4.983604 -0.689808
O 0.296922 5.510188 1.475456
O 4.608947 -3.127578 1.027336
O -2.283753 1.527117 1.815793
O -4.042811 -2.182569 -0.800200
O -4.775876 2.218225 1.759471
O -4.337436 0.182073 0.301263
O -4.001099 -0.168779 3.092449
N 0.419959 -1.144179 -0.289441
N -0.153171 -2.813126 -2.092497
N -1.659618 -1.012145 0.649573
N -2.522707 -3.362965 -2.166893
N -1.022310 -4.409955 -3.619298
C 2.286290 0.522669 0.018330
C 3.806069 0.407332 -0.292069
C 1.729131 -0.698333 -0.738818
C 4.069152 -1.109880 -0.279640
C 1.441001 2.828891 0.416193
C 0.798146 3.973978 -0.385630
C -0.296215 4.531669 0.571869
C -0.731571 3.302283 1.395214
C 4.571352 -1.669143 1.059130
C -1.950307 2.562362 0.833769
C -0.413541 -2.001919 -0.999211
C -0.404515 -0.573454 0.729347
C -1.687476 -1.898454 -0.435895
C -2.837187 -2.487156 -1.105686
C -1.272244 -3.518154 -2.599159
H 2.097412 0.447818 1.103950
H 4.424107 0.949032 0.451782
H 1.670817 -0.446442 -1.818610
H 4.745023 -1.390307 -1.104765
H 2.398965 3.114764 0.891104
H 0.347088 3.553246 -1.303914
H -1.140480 4.985199 0.014482
H -0.926011 3.587538 2.441099
H 3.935500 -1.302323 1.894894
H 5.612587 -1.349629 1.235632
H -1.736892 2.100354 -0.151791
H -2.796100 3.271351 0.734830
H 3.528937 1.728575 -1.764780
H -0.057582 0.186075 1.424454
H 1.618613 5.427579 -1.550597
H 1.068686 5.921484 0.995872
H 0.799504 -2.971722 -2.429449
H 3.699673 -3.444233 0.786314
H -1.829647 -4.907681 -3.988479
H -0.095466 -4.604400 -3.988460
H -5.652466 2.081802 1.318824
H -4.196361 -0.806655 0.006839


