%chk=000002772.chk
%nprocshared=4
%mem=4GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002772

1 1
 P    3.024500       2.477000      0.4430000    
 P    4.120400     -8.0799997E-02   1.398800    
 O   -2.384600       1.038200      -2.129800    
 O  -0.7239000       3.514700      -1.584900    
 O  -0.6771000      0.3938000      0.3043000    
 O    1.573300       2.780500     -0.2055000    
 O    2.973900      0.9095000      0.8352000    
 O    3.392400      -1.525400       1.386000    
 O   -4.444700       2.061700       1.257800    
 O    4.043000       2.511800     -0.8135000    
 O    3.408400       3.383000       1.576700    
 O    5.167600     -0.1622000      0.1684000    
 O    4.716300      0.3365000       2.711500    
 N   -3.408600      0.4989000     -8.8200003E-02
 N    1.612300      -3.828500     -0.8870000    
 N   -5.090800     -9.5600002E-02   1.541600    
 N   -5.747100      -2.308000       1.828900    
 C  -0.4121000       2.136200      -1.367000    
 C   -1.196900       1.634700     -0.1633000    
 C   -2.584600       1.453000     -0.7698000    
 C   -1.024800       1.331200      -2.508200    
 C    1.099700       1.991500      -1.283400    
 C   -3.304000     -0.8422000     -0.4312000    
 C   -4.326300      0.8808000      0.9259000    
 C    2.188100      -3.344000      0.3927000    
 C   0.5101000      -2.881900      -1.381400    
 C    2.693200      -3.911500      -1.973300    
 C    1.000200      -5.225300     -0.7147000    
 C    2.809300      -1.978100      0.1766000    
 C   -4.029200      -1.796000      0.1496000    
 C   -4.978000      -1.353400       1.204400    
 H   -1.219100       2.335600      0.6770000    
 H   -3.102200       2.419500     -0.8097000    
 H  -0.5211000      0.3706000      -2.659900    
 H   -1.044000       1.873400      -3.458500    
 H    1.399000      0.9470000      -1.156400    
 H    1.571200       2.369300      -2.197400    
 H  -0.2731000       3.800500      -2.397800    
 H  -0.5997000     -0.2168000     -0.4469000    
 H   -2.590000      -1.116500      -1.199400    
 H    1.393900      -3.302200       1.148200    
 H    2.937300      -4.065800      0.7406000    
 H  -5.0000002E-04  -3.364800      -2.220900    
 H   0.9490000      -1.944200      -1.730300    
 H  -0.1934000      -2.713100     -0.5610000    
 H    2.962800      -2.908400      -2.312400    
 H    2.278300      -4.465200      -2.821900    
 H    3.556100      -4.444700      -1.564000    
 H   0.5820000      -5.548300      -1.672500    
 H   0.2157000      -5.160300      4.4799998E-02
 H    1.793400      -5.906000     -0.3920000    
 H    2.067300      -1.236400     -0.1234000    
 H    3.605100      -2.012800     -0.5673000    
 H   -3.947100      -2.842800     -0.1109000    
 H    5.008100       2.472900     -0.6423000    
 H   -6.407400      -2.051200       2.554900    
 H   -5.682100      -3.292000       1.590000    
 H    4.836700     -0.2920000     -0.7454000    


%chk=000002772-Freq.chk
%nprocshared=4
%mem=4GB
#p freq=noraman PBEPBE/SDD

000002772

1 1
P 3.290483 2.175967 0.204760
P 3.184685 -0.504882 -1.414583
O -2.314331 2.238161 -1.883838
O -0.654664 3.098722 0.701286
O 0.200141 1.081440 -2.342198
O 1.942957 3.239192 0.212171
O 2.510514 0.661910 -0.286039
O 3.253973 -1.964926 -0.510670
O -1.002518 -1.261086 0.020675
O 4.113813 2.629907 -1.212145
O 3.998028 2.110556 1.605535
O 1.885638 -0.757004 -2.428712
O 4.594511 -0.006271 -1.947617
N -2.310408 -0.137798 -1.567777
N 0.999438 -3.724477 1.954728
N -2.258565 -2.556563 -1.465569
N -3.536796 -3.823338 -2.941197
C -0.278330 2.904254 -0.701879
C -0.335072 1.373819 -0.990907
C -1.856030 1.148271 -0.992593
C -1.468709 3.439905 -1.546368
C 1.095201 3.544708 -0.976003
C -3.238874 -0.179912 -2.595505
C -1.823695 -1.357026 -0.958028
C 2.260562 -3.330472 1.152287
C 0.349407 -2.487188 2.587570
C -0.025346 -4.424029 1.057146
C 1.442151 -4.677150 3.064216
C 1.956340 -2.604078 -0.166154
C -3.685694 -1.387804 -3.090619
C -3.152570 -2.590930 -2.492639
H 0.230293 0.767233 -0.279795
H -2.247757 1.270735 0.033674
H -1.180283 3.897333 -2.507201
H -2.063519 4.141328 -0.941161
H 1.558420 3.175405 -1.905880
H 1.028590 4.644962 -0.992395
H 0.188550 3.130981 1.233029
H -0.467396 1.313161 -3.037908
H -3.583238 0.785763 -2.969517
H 2.863121 -2.671254 1.799036
H 2.827126 -4.257992 0.965577
H -0.460285 -2.828175 3.251905
H -0.075104 -1.854105 1.794166
H 1.111131 -1.947885 3.171285
H -0.462874 -3.695223 0.355431
H -0.823869 -4.830557 1.697655
H 0.474503 -5.244483 0.518425
H 0.572856 -4.924941 3.691824
H 2.214287 -4.183585 3.674072
H 1.851331 -5.594363 2.613659
H 1.150511 -1.856436 -0.057765
H 1.686795 -3.293515 -0.982828
H -4.417659 -1.415618 -3.899295
H 4.650890 1.877301 -1.629111
H -3.147769 -4.652290 -2.493925
H -4.199869 -3.933713 -3.705208
H 1.161175 0.013457 -2.481683


