%chk=000093437.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093437

0 1
 P   4.9999999E-03 -7.9599999E-02 -0.3172000    
 O  -0.7958000      -1.315400      0.3503000    
 O  -0.5898000       1.205500      0.4705000    
 O    1.491500     -0.2339000      0.2999000    
 O  -6.4999998E-02 -1.7000000E-03  -1.816700    
 C  -0.5489000      -2.637900      9.9500000E-02
 C   -1.873600       1.653600      0.3847000    
 C    2.509800      0.6642000      0.1285000    
 C   0.3710000      -3.331700      0.8817000    
 C   -1.218200      -3.283000     -0.9374000    
 C   -2.683400       1.719500       1.518500    
 C    3.093900       1.289100       1.226200    
 C   -2.376100       2.048900     -0.8550000    
 C    2.953300      0.9445000      -1.160800    
 C   -3.688100       2.510300     -0.9610000    
 C    3.990100       1.857400      -1.353800    
 C   0.6230000      -4.679400      0.6253000    
 C  -0.9664000      -4.630900      -1.193500    
 C   -3.995600       2.180600       1.412600    
 C    4.130700       2.202100       1.033300    
 C   -4.497900       2.576200      0.1728000    
 C    4.578900       2.486100     -0.2567000    
 C  -4.5800000E-02  -5.329100     -0.4122000    
 C    1.096600      -2.654500       1.997500    
 C   -2.207100      -2.552900      -1.785300    
 C   -2.162400       1.300600       2.853600    
 C    2.627400      0.9970000       2.614200    
 C   -4.225800       2.932200      -2.286500    
 C    4.468700       2.162100      -2.733000    
 H   -1.745000       2.012200      -1.738600    
 H    2.506900      0.4464000      -2.016600    
 H    1.339500      -5.233900       1.225700    
 H   -1.478500      -5.149000      -2.000200    
 H   -4.639800       2.237400       2.286000    
 H    4.600200       2.700200       1.877500    
 H   -5.522600       2.931700      0.1031000    
 H    5.386200       3.200600     -0.3939000    
 H   0.1513000      -6.378200     -0.6123000    
 H    1.198200      -3.334200       2.851500    
 H    2.100300      -2.362800       1.674900    
 H   0.5667000      -1.773300       2.372000    
 H   -1.701200      -2.076000      -2.630000    
 H   -2.745900      -1.789700      -1.214300    
 H   -2.965300      -3.237300      -2.182000    
 H   -1.870200      0.2454000       2.833200    
 H   -1.293800       1.907400       3.130200    
 H   -2.912700       1.420300       3.642300    
 H    3.093700       1.661100       3.349700    
 H    1.544000       1.136400       2.693100    
 H    2.877100     -3.3100002E-02   2.887700    
 H   -3.442600       3.388800      -2.901200    
 H   -4.632100       2.066900      -2.819500    
 H   -5.020100       3.678100      -2.174100    
 H    3.870700       2.968800      -3.168200    
 H    5.520200       2.468800      -2.729800    
 H    4.394400       1.280700      -3.378900    


%chk=000093437-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093437

0 1
P 0.140402 -0.100350 -0.140590
O -0.572274 -1.451385 0.677310
O -0.603202 1.196985 0.734312
O 1.716043 -0.064025 0.577521
O 0.068678 -0.060411 -1.726494
C -0.477634 -2.804552 0.190191
C -1.968364 1.577624 0.487394
C 2.688755 0.925817 0.192038
C 0.462396 -3.657309 0.822929
C -1.403102 -3.239008 -0.792671
C -2.880846 1.418978 1.560700
C 3.087144 1.854393 1.186283
C -2.322617 2.144182 -0.750952
C 3.249643 0.884168 -1.097265
C -3.650908 2.590682 -0.967726
C 4.268802 1.803870 -1.452119
C 0.482305 -5.012233 0.408055
C -1.343670 -4.603861 -1.170648
C -4.199923 1.878362 1.328010
C 4.112256 2.758291 0.815996
C -4.581382 2.449786 0.091895
C 4.691370 2.738220 -0.474092
C -0.407426 -5.482282 -0.582899
C 1.390250 -3.144435 1.905344
C -2.412672 -2.291257 -1.408138
C -2.455656 0.783930 2.867801
C 2.437583 1.871138 2.553747
C -4.047850 3.213953 -2.294576
C 4.888345 1.770507 -2.838409
H -1.567644 2.227950 -1.540563
H 2.885411 0.145746 -1.819958
H 1.200026 -5.697277 0.873801
H -2.043099 -4.973134 -1.929348
H -4.941114 1.777068 2.129546
H 4.454325 3.495363 1.552070
H -5.614509 2.787513 -0.051068
H 5.478236 3.459435 -0.724206
H -0.376505 -6.533249 -0.890666
H 2.078308 -3.939854 2.237381
H 1.985562 -2.282411 1.555821
H 0.816971 -2.790688 2.782400
H -1.913020 -1.535151 -2.041915
H -2.973355 -1.740057 -0.631136
H -3.134847 -2.843168 -2.032692
H -2.006799 -0.211247 2.695056
H -1.686365 1.392863 3.377883
H -3.316380 0.671367 3.548510
H 2.827135 2.703767 3.163458
H 1.340851 1.977340 2.466234
H 2.620992 0.925578 3.096688
H -3.590742 4.214260 -2.419357
H -3.712949 2.595336 -3.147024
H -5.142036 3.335497 -2.370452
H 4.113047 1.792420 -3.626045
H 5.561048 2.630373 -2.999052
H 5.480603 0.848179 -2.991013


