%chk=000086479.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086479

0 1
 P   -4.244100      -1.788200      3.8899999E-02
 O   -1.083800      0.9335000       1.147500    
 O   0.6663000       3.018900      -1.184900    
 O   -1.452400       3.795300      0.3448000    
 O   -3.426600     -0.5127000      0.6103000    
 O   -3.244400      -2.422700      -1.062600    
 O   -5.400900      -1.103200     -0.8596000    
 O    4.506500      -2.790900     -0.3900000    
 O   -4.737000      -2.745200       1.084700    
 N   0.9920000      0.2149000      0.2571000    
 N   0.5278000      -1.016900     -1.5900001E-02
 N    3.275100       1.046800      0.4150000    
 N    5.023400     -0.5806000      5.8800001E-02
 C  -0.2578000       2.027000     -0.7847000    
 C   0.1411000       1.348300      0.5162000    
 C   -1.610400       2.611600     -0.4370000    
 C   -2.202500       1.533200      0.4591000    
 C   -2.926900      0.4387000     -0.3130000    
 C    2.365300      0.1491000      0.2280000    
 C    2.760200      -1.255800     -7.7699997E-02
 C    1.579800      -1.882700     -0.1931000    
 C    4.164300      -1.638900     -0.1552000    
 C    4.585000      0.6203000      0.3134000    
 H  -0.3654000       1.304000      -1.602500    
 H   0.6498000       2.041200       1.196900    
 H   -2.219200       2.866600      -1.308100    
 H   -2.863300       1.946700       1.229500    
 H   -2.248000     -7.0200004E-02  -1.003600    
 H   -3.757600      0.8681000     -0.8814000    
 H  -0.4024000      -1.336200      0.2171000    
 H    1.528600       2.584400      -1.299900    
 H   -1.002600       3.568700       1.175600    
 H    1.382800      -2.926200     -0.3782000    
 H    5.343300       1.405100      0.4710000    
 H   -3.496100      -3.261200      -1.504900    
 H   -6.098100      -1.672200      -1.250000    


%chk=000086479-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000086479

0 1
P -3.628876 -1.730182 -0.281790
O -1.554396 0.625087 1.009017
O 0.888868 2.989878 -0.351184
O -1.302618 3.782880 0.992913
O -4.083361 -0.107330 -0.025640
O -2.435267 -2.170741 0.916288
O -2.541350 -1.609276 -1.603488
O 4.153577 -2.957306 -0.883549
O -4.839040 -2.739326 -0.359050
N 0.574006 -0.167389 0.318017
N 0.197622 -1.489583 0.560248
N 2.588427 0.946968 -0.485291
N 4.414401 -0.609497 -1.083054
C -0.219707 2.079098 -0.393895
C -0.181678 1.019516 0.748451
C -1.543829 2.816211 -0.068508
C -2.463610 1.699163 0.477658
C -3.356920 1.068111 -0.592909
C 1.871366 -0.160565 -0.159172
C 2.309978 -1.522746 -0.248382
C 1.230311 -2.312212 0.193005
C 3.674751 -1.793435 -0.751417
C 3.869796 0.602402 -0.940104
H -0.301427 1.546661 -1.365508
H 0.282444 1.446313 1.659983
H -1.965320 3.312476 -0.966107
H -3.057349 2.070643 1.328591
H -2.784305 0.753175 -1.482889
H -4.165634 1.759858 -0.882953
H -0.809775 -1.708393 0.767710
H 1.743637 2.387324 -0.437951
H -0.377019 4.128541 0.839398
H 1.136073 -3.393686 0.251320
H 4.494517 1.461327 -1.212137
H -2.803038 -2.342568 1.819432
H -2.563457 -2.362794 -2.245454


