%chk=000079837.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079837

0 1
 P  -0.3713000      -2.157700       1.172900    
 O   0.7310000      -2.131000     -1.4400000E-02
 O  -0.4202000     -0.6125000       1.657700    
 O   -1.782400      -2.386900      0.4096000    
 O  -8.9000002E-02  -3.148300       2.266800    
 C    1.688900      -1.365800      -2.086100    
 C   0.3045000       1.300500       2.926800    
 C   -4.159000      -2.083300      0.1754000    
 C   0.5442000      -1.225500      -1.088600    
 C   0.5290000     -0.1750000       2.615000    
 C   -2.999900      -2.334800       1.133600    
 C    3.027800      -1.033400      -1.473600    
 C   0.4857000       2.177800       1.711900    
 C   -4.032100     -0.7628000     -0.5447000    
 C    3.506900      0.2762000      -1.512700    
 C    1.742200       2.705500       1.413900    
 C   -4.588200      0.3902000      9.6000005E-03
 C    3.786100      -2.035500     -0.8680000    
 C  -0.6029000       2.460400      0.8867000    
 C   -3.358300     -0.6952000      -1.764200    
 C    4.744000      0.5836000     -0.9466000    
 C    1.909900       3.516000      0.2912000    
 C   -4.470800       1.610600     -0.6556000    
 C    5.023300      -1.727900     -0.3017000    
 C  -0.4350000       3.271000     -0.2360000    
 C   -3.240900      0.5253000      -2.429300    
 C    5.502100     -0.4183000     -0.3411000    
 C   0.8215000       3.798600     -0.5338000    
 C   -3.797100       1.678100      -1.875000    
 H    1.507900     -0.7184000      -2.952800    
 H    1.721800      -2.393700      -2.469300    
 H   0.9904000       1.621500       3.720000    
 H  -0.7108000       1.445300       3.317800    
 H   -5.108400      -2.116100      0.7236000    
 H   -4.204100      -2.888000     -0.5696000    
 H  -0.3991000      -1.455000      -1.591400    
 H   0.4954000     -0.2022000     -0.7033000    
 H   0.4101000     -0.7648000       3.529700    
 H    1.536700     -0.3445000       2.219400    
 H   -3.136800      -3.292000       1.646400    
 H   -2.944800      -1.544300       1.890200    
 H    2.923900       1.065700      -1.979500    
 H    2.598600       2.489400       2.047100    
 H   -5.112900      0.3506000      0.9604000    
 H    3.425000      -3.059700     -0.8306000    
 H   -1.586900       2.055300       1.107300    
 H   -2.922600      -1.586100      -2.208400    
 H    5.115900       1.603600     -0.9757000    
 H    2.888700       3.925000      5.7999998E-02
 H   -4.902000       2.508600     -0.2232000    
 H    5.613600      -2.507900      0.1701000    
 H   -1.281900       3.492400     -0.8784000    
 H   -2.715300      0.5782000      -3.378200    
 H    6.465000     -0.1788000      0.1004000    
 H   0.9522000       4.428900      -1.408500    
 H   -3.704200       2.628600      -2.392100    


%chk=000079837-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000079837

0 1
P -0.283883 -2.499737 0.964643
O 0.575820 -2.699469 -0.502217
O -0.110593 -0.837775 1.431229
O -1.895647 -2.418290 0.365330
O 0.086758 -3.574737 2.065101
C 1.821454 -1.623239 -2.297044
C 0.845237 1.025364 2.669969
C -4.247231 -1.826361 0.429279
C 0.459517 -1.674322 -1.583500
C 1.109586 -0.408641 2.181443
C -3.010401 -2.103750 1.300572
C 2.944738 -1.121856 -1.401308
C 0.778323 2.070800 1.563196
C -4.130735 -0.561004 -0.407870
C 3.204782 0.266613 -1.269176
C 1.790872 3.056122 1.439099
C -4.579322 0.686187 0.097783
C 3.726248 -2.034652 -0.646889
C -0.294318 2.081016 0.631892
C -3.547489 -0.597922 -1.700440
C 4.225239 0.733385 -0.409413
C 1.742190 4.024293 0.408897
C -4.448878 1.869018 -0.665646
C 4.749324 -1.572103 0.212038
C -0.344704 3.044688 -0.399884
C -3.419204 0.580745 -2.469415
C 5.004541 -0.185363 0.331575
C 0.673731 4.020098 -0.517087
C -3.868870 1.819435 -1.954402
H 1.700844 -0.962523 -3.178292
H 2.049065 -2.636101 -2.676568
H 1.659877 1.280481 3.375245
H -0.095491 1.012267 3.253606
H -5.114962 -1.755250 1.114071
H -4.411811 -2.709098 -0.215447
H -0.342490 -2.005804 -2.266921
H 0.192813 -0.693521 -1.147552
H 1.260924 -1.095942 3.035102
H 1.981276 -0.454014 1.503567
H -3.178855 -2.977807 1.957266
H -2.740521 -1.221376 1.910961
H 2.602421 0.990414 -1.832880
H 2.622881 3.066266 2.154880
H -5.040711 0.732016 1.092701
H 3.520029 -3.107808 -0.725702
H -1.084907 1.328174 0.714820
H -3.193988 -1.556065 -2.098242
H 4.407042 1.810211 -0.319994
H 2.531147 4.781897 0.334178
H -4.804716 2.822882 -0.259999
H 5.344141 -2.291408 0.786356
H -1.184141 3.033226 -1.104424
H -2.974506 0.533518 -3.470293
H 5.801322 0.173839 0.992883
H 0.631185 4.772039 -1.313544
H -3.779551 2.732442 -2.554438


