%chk=000065356.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065356

0 1
 P   -5.010200     -0.9518000      0.4128000    
 O   -1.037500      0.7829000      0.5980000    
 O   -3.769300      7.2300002E-02  0.5848000    
 O   -4.419100      -2.114600     -0.5431000    
 O   -6.012700     -0.1416000     -0.5637000    
 O   -5.623400      -1.427300       1.697400    
 N    1.209800      0.3338000     -2.0999999E-03
 N    1.998300      -1.562100     -0.8686000    
 N    3.251700       1.237100      0.9541000    
 N    5.146900     -0.2493000      0.5608000    
 N    4.934100      -2.315700     -0.6274000    
 C   0.2500000       1.378800      0.3574000    
 C   -2.012000       1.500400     -0.1760000    
 C   7.2300002E-02   2.446400     -0.7172000    
 C   -1.251000       2.085000      -1.351500    
 C   -3.135200      0.5676000     -0.5839000    
 C    2.544200      0.3135000      0.2863000    
 C   0.9292000     -0.8132000     -0.6957000    
 C    3.014900     -0.8700000     -0.2599000    
 C    4.371000      -1.139100     -0.1039000    
 C    4.547900      0.8670000       1.041400    
 H   0.6003000       1.818400       1.298100    
 H   -2.400700       2.297200      0.4707000    
 H   0.8938000       2.501600      -1.437900    
 H  -1.5699999E-02   3.429600     -0.2387000    
 H   -1.760000       2.939100      -1.806700    
 H   -1.088200       1.328200      -2.128200    
 H   -2.735400     -0.2814000      -1.147900    
 H   -3.864000       1.099500      -1.203000    
 H  -6.2300000E-02  -1.052800      -1.055000    
 H    5.198900       1.556800       1.567700    
 H    5.922000      -2.488700     -0.5011000    
 H    4.357200      -2.981100      -1.124000    
 H   -4.977200      -2.897000     -0.7394000    
 H   -6.898600     -0.5179000     -0.7523000    


%chk=000065356-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000065356

0 1
P -3.198550 -1.262651 -0.932184
O -1.833868 1.100260 1.076835
O -3.224807 0.374313 -1.514694
O -3.159677 -1.148216 0.772346
O -1.565776 -1.655338 -1.378132
O -4.347628 -2.167962 -1.510212
N 0.363958 0.057929 1.015459
N 0.901224 -2.145154 0.613808
N 1.829217 1.122036 -0.725261
N 3.135707 -0.547299 -1.974074
N 2.973490 -2.866917 -1.563084
C -0.448738 1.147818 1.594082
C -1.971512 2.031556 -0.105349
C 0.019251 2.577408 1.271946
C -0.725711 2.957292 -0.039867
C -2.032317 1.244486 -1.425220
C 1.303054 0.065036 -0.037763
C 0.169463 -1.297900 1.353539
C 1.624577 -1.302335 -0.252935
C 2.583217 -1.591637 -1.268324
C 2.734607 0.721299 -1.670844
H -0.537802 0.948270 2.674313
H -2.925270 2.556304 0.069726
H 1.110243 2.644106 1.145325
H -0.293368 3.228925 2.104960
H -1.015215 4.020107 -0.042738
H -0.055643 2.767781 -0.895942
H -1.114070 0.652448 -1.585439
H -2.155186 1.959454 -2.257750
H -0.531564 -1.599266 2.129707
H 3.197477 1.519141 -2.259247
H 3.654156 -3.014553 -2.305916
H 2.579881 -3.653901 -1.051238
H -2.721325 -0.272079 1.075344
H -1.151495 -2.419165 -0.898879


