%chk=000001757.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001757

0 1
 P   -5.663300       1.168700      0.2781000    
 P    5.661400       1.169300     -0.2781000    
 O   -4.648800      0.6598000     -0.8763000    
 O    4.646900      0.6599000      0.8762000    
 O   -4.797100       2.246200       1.117900    
 O   -6.701200       2.099800     -0.5432000    
 O    4.795100       2.247000      -1.117500    
 O    6.699300       2.100300      0.5434000    
 O   -6.310500      8.2199998E-02   1.086600    
 O    6.308800      8.3099999E-02  -1.086900    
 C  -7.9999998E-04  -2.416000     -5.0000002E-04
 C   -1.229300      -1.603200     -0.2319000    
 C    1.247900      -1.589800      0.2349000    
 C   -1.580200      -1.223000      -1.527100    
 C    1.578600      -1.223300       1.526400    
 C   -2.027600      -1.223200      0.8470000    
 C    2.025900      -1.222800     -0.8477000    
 C   -2.729300     -0.4624000      -1.743600    
 C    2.727600     -0.4628000       1.743100    
 C   -3.176800     -0.4627000      0.6308000    
 C    3.175100     -0.4623000     -0.6312000    
 C   -3.527700     -8.2500003E-02 -0.6647000    
 C    3.526000     -8.2400002E-02  0.6644000    
 H  -0.1553000      -3.094400      0.8503000    
 H   0.1651000      -3.094200     -0.8494000    
 H  -0.9679000      -1.512600      -2.377100    
 H   0.9639000      -1.515100       2.372800    
 H   -1.765400      -1.512500       1.861300    
 H    1.760300      -1.513800      -1.859700    
 H   -2.997700     -0.1690000      -2.754800    
 H    2.995800     -0.1697000       2.754300    
 H   -3.763500     -0.1877000       1.499900    
 H    3.761700     -0.1870000      -1.500400    
 H   -5.191600       2.650100       1.920000    
 H   -7.488400       2.455800     -7.8500003E-02
 H    5.189500       2.651100      -1.919600    
 H    7.486500       2.456300      7.8900002E-02


%chk=000001757-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001757

0 1
P -5.928300 1.182136 0.707113
P 5.927879 1.195073 -0.714873
O -4.913409 0.605610 -0.570044
O 4.903742 0.641284 0.565109
O -5.048581 2.578772 1.202858
O -7.183926 1.739496 -0.298618
O 5.049173 2.577914 -1.248577
O 7.170960 1.778577 0.291603
O -6.386669 0.235439 1.888058
O 6.399658 0.225207 -1.871611
C 0.004567 -2.377067 0.010372
C -1.284417 -1.563669 -0.094971
C 1.288509 -1.554645 0.108113
C -1.404383 -0.507572 -1.036301
C 1.399769 -0.484994 1.035105
C -2.403192 -1.870823 0.717707
C 2.411573 -1.866924 -0.696620
C -2.603538 0.222201 -1.163808
C 2.594598 0.252844 1.156327
C -3.619893 -1.161688 0.599250
C 3.624149 -1.149784 -0.584096
C -3.699443 -0.118131 -0.345679
C 3.695023 -0.092821 0.346517
H -0.069794 -3.041024 0.894563
H 0.083230 -3.048895 -0.867475
H -0.546285 -0.245322 -1.665611
H 0.538258 -0.218637 1.657976
H -2.331937 -2.681946 1.452200
H 2.347147 -2.688569 -1.419965
H -2.701161 1.043508 -1.879666
H 2.685521 1.084539 1.860983
H -4.482086 -1.414651 1.225143
H 4.489729 -1.407040 -1.203557
H -5.172609 2.811823 2.158822
H -6.920053 1.873372 -1.245730
H 5.178750 2.788526 -2.209005
H 6.900442 1.915080 1.236487


