%chk=000003856.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003856

0 1
 P   -1.158600      -3.228500      0.4636000    
 O   0.2562000      -2.562500      5.4699998E-02
 O    3.543800       1.517600      -1.630300    
 O   -3.934700      0.9480000      1.4500000E-02
 O   -1.015000       4.869500      0.1681000    
 O   0.1219000       4.005600       1.930300    
 O  -0.8288000      -3.918400       1.888500    
 O   -2.078500      -1.961400      0.8680000    
 O   -1.749500      -4.148400     -0.5645000    
 N   0.7464000       1.787000      0.3679000    
 N    4.544100      -1.500700      0.1569000    
 N   -6.340900      -1.330400      -1.576500    
 C    2.226500     -2.6699999E-02 -0.3628000    
 C   0.9804000      0.7697000     -0.6451000    
 C    2.160600      -1.182300      0.4075000    
 C  -0.4699000       2.543200      7.1400002E-02
 C    3.449900      0.3928000     -0.8737000    
 C   0.8781000      -1.678200      0.9800000    
 C    4.569000     -0.3725000     -0.5875000    
 C    3.337400      -1.877100      0.6364000    
 C   -1.763100       1.871900      0.4481000    
 C    5.907600      3.2900002E-02  -1.111800    
 C  -0.3966000       3.856200      0.8307000    
 C   -2.770800       1.555200     -0.3755000    
 C   -4.470800      0.1507000      -1.028400    
 C   -5.744600     -0.5132000     -0.5303000    
 H   0.1214000      9.2900001E-02 -0.7270000    
 H    1.042800       1.216000      -1.646400    
 H    1.543700       2.424200      0.3774000    
 H  -0.4709000       2.811400     -0.9945000    
 H   0.1993000     -0.8672000       1.258300    
 H    1.083500      -2.225800       1.907600    
 H    3.351900      -2.787600       1.227800    
 H   -1.876300       1.608900       1.499400    
 H    6.182900       1.022600     -0.7336000    
 H    6.683300     -0.6733000     -0.7971000    
 H    5.899200      5.4699998E-02  -2.206200    
 H    2.807500       2.119300      -1.437000    
 H   -2.729400       1.786500      -1.432200    
 H   -4.702700      0.7779000      -1.899800    
 H   -3.740700     -0.6136000      -1.326900    
 H  -0.9796000       5.710400      0.6721000    
 H   -6.459900      0.2504000     -0.2044000    
 H   -5.525700      -1.129400      0.3493000    
 H   -1.513100      -4.476900       2.315000    
 H   -3.021900      -2.110700       1.090700    
 H   -5.688600      -2.062300      -1.855500    
 H   -7.163100      -1.806300      -1.207300    


%chk=000003856-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000003856

0 1
P -1.769551 -2.468359 0.553066
O -0.238828 -1.874304 0.064970
O 3.774608 1.286561 -1.927501
O -3.615973 0.519491 -0.009521
O -1.549807 4.652312 1.196253
O 0.712398 4.340767 1.615046
O -1.301365 -3.596985 1.760751
O -2.540191 -1.310037 1.543412
O -2.624069 -2.981169 -0.683515
N 0.743380 1.927088 0.306570
N 4.367687 -1.665504 0.158495
N -5.533573 -2.164932 -1.661970
C 2.178761 0.062720 -0.464159
C 1.016095 0.988616 -0.792073
C 2.014065 -1.035244 0.431624
C -0.499576 2.709911 0.199882
C 3.463812 0.249050 -1.031194
C 0.702753 -1.315373 1.113489
C 4.545565 -0.625749 -0.703046
C 3.129114 -1.857248 0.701090
C -1.691929 1.848118 0.573442
C 5.911548 -0.417122 -1.307182
C -0.352094 3.956022 1.083146
C -2.591282 1.428897 -0.347052
C -4.283546 -0.149752 -1.181303
C -5.364195 -1.109246 -0.652218
H 0.114460 0.370063 -0.954156
H 1.186977 1.517837 -1.770877
H 1.544185 2.463208 0.662694
H -0.670242 3.109395 -0.834401
H 0.250507 -0.391423 1.514730
H 0.818388 -2.068433 1.911422
H 3.032304 -2.713218 1.378984
H -1.730264 1.479988 1.604907
H 6.323568 0.570387 -1.028080
H 6.587653 -1.210266 -0.954162
H 5.863199 -0.432183 -2.411489
H 2.960013 1.791106 -2.181804
H -2.584223 1.760483 -1.394641
H -4.705108 0.634486 -1.834649
H -3.517083 -0.731766 -1.724295
H -1.411531 5.468467 1.749968
H -6.318978 -0.572318 -0.512680
H -5.049511 -1.482102 0.349665
H -2.010072 -3.814799 2.417089
H -3.056015 -0.577566 1.031498
H -4.742939 -2.821142 -1.672076
H -6.445398 -2.626632 -1.658248


