%chk=000145821.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145821

0 1
 P   3.7500001E-02  -1.399100     -0.2599000    
 O  -0.2313000      -2.474300      0.9082000    
 O  -1.4100000E-02  -1.977000      -1.635100    
 C   -2.672600     -0.6026000     -0.2378000    
 C    2.142300      0.3030000     -0.9619000    
 C   -1.226200     -0.1318000     -1.4300000E-02
 C    1.585200     -0.6251000      0.1298000    
 C   -3.635600      0.2731000      0.5957000    
 C    3.049700       1.374300     -0.3157000    
 C   -3.069500     -0.6258000      -1.727400    
 C    2.874900     -0.4639000      -2.080900    
 C   -3.686900       1.761600      0.2290000    
 C    4.311200      0.8586000      0.3884000    
 C   -4.465400      -1.175600      -1.987300    
 C    3.357300      0.4199000      -3.223200    
 C   -4.607500       2.584100       1.130600    
 C    5.131200       1.958900       1.061800    
 C  -0.1751000      -2.135000       2.281200    
 C   -4.542600       4.064500      0.7858000    
 C    6.312400       1.380500       1.826500    
 C  -0.4750000      -3.368100       3.106500    
 H   -2.755600      -1.627000      0.1477000    
 H    1.297300      0.8335000      -1.419000    
 H   -1.001400      0.6987000     -0.6933000    
 H   -1.099700      0.2638000      0.9989000    
 H    2.319600      -1.407800      0.3533000    
 H    1.440600     -5.6299999E-02   1.055400    
 H   -3.347700      0.1875000       1.652500    
 H   -4.649300     -0.1418000      0.5437000    
 H    3.341000       2.114400      -1.070700    
 H    2.451200       1.935500      0.4149000    
 H   -2.362100      -1.258400      -2.273800    
 H   -2.983200      0.3729000      -2.169700    
 H    2.198300      -1.210500      -2.508200    
 H    3.722900      -1.027100      -1.675100    
 H   -4.024000       1.875100     -0.8074000    
 H   -2.676600       2.183900      0.2816000    
 H    4.952100      0.3411000     -0.3343000    
 H    4.027900      0.1196000       1.146800    
 H   -4.597600      -2.154400      -1.515800    
 H   -4.625300      -1.294900      -3.063900    
 H   -5.241100     -0.5003000      -1.615300    
 H    2.541200       1.032400      -3.619100    
 H    3.740400     -0.2011000      -4.039600    
 H    4.169600       1.080600      -2.907600    
 H   -5.639500       2.229600       1.028800    
 H   -4.318700       2.448200       2.179200    
 H    5.494600       2.665200      0.3068000    
 H    4.497300       2.522400       1.756100    
 H  -0.9118000      -1.359500       2.504500    
 H   0.8222000      -1.762300       2.529900    
 H   -4.849100       4.239400     -0.2504000    
 H   -5.210700       4.634700       1.438900    
 H   -3.527700       4.454000      0.9151000    
 H    6.981200      0.8302000       1.157100    
 H    6.888100       2.183500       2.297400    
 H    5.975100      0.6982000       2.613400    
 H  -0.4389000      -3.141400       4.175700    
 H   0.2466000      -4.162500       2.889100    
 H   -1.466600      -3.763300       2.862300    


%chk=000145821-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000145821

0 1
P 0.052756 -1.264959 -0.255213
O -0.247790 -2.488290 0.990000
O 0.014964 -1.967813 -1.695334
C -2.726833 -0.528055 -0.189202
C 2.278399 0.481514 -0.845608
C -1.293335 0.028606 0.038086
C 1.708864 -0.494814 0.224001
C -3.768251 0.312684 0.606124
C 3.321824 1.439737 -0.197246
C -3.034936 -0.643960 -1.709202
C 2.822545 -0.303105 -2.073358
C -3.890828 1.797494 0.192714
C 4.574015 0.759554 0.403759
C -4.370387 -1.352687 -2.020757
C 3.256744 0.600236 -3.247189
C -4.920036 2.568811 1.051028
C 5.562017 1.778331 1.018738
C -0.330007 -2.125491 2.421055
C -5.051554 4.053116 0.647313
C 6.812315 1.109760 1.629641
C -0.618912 -3.422580 3.177111
H -2.761113 -1.557008 0.231318
H 1.448572 1.127878 -1.211578
H -1.079991 0.872471 -0.644360
H -1.166762 0.393589 1.075880
H 2.402237 -1.337794 0.400332
H 1.552579 0.027719 1.188076
H -3.512290 0.263467 1.686616
H -4.761913 -0.168451 0.508514
H 3.647422 2.175411 -0.959525
H 2.817888 2.027457 0.599394
H -2.205572 -1.202718 -2.183187
H -3.035201 0.368488 -2.162831
H 2.032677 -0.998698 -2.415674
H 3.675329 -0.935132 -1.752744
H -4.186345 1.869072 -0.873310
H -2.904150 2.298415 0.277959
H 5.099543 0.175660 -0.378409
H 4.274945 0.033727 1.187512
H -4.391098 -2.364611 -1.573800
H -4.504791 -1.468297 -3.111763
H -5.243073 -0.793169 -1.635220
H 2.423965 1.252561 -3.573136
H 3.559079 -0.011375 -4.116640
H 4.112160 1.249811 -2.984087
H -5.908198 2.071929 0.965827
H -4.629810 2.498490 2.119702
H 5.871313 2.501781 0.236898
H 5.038068 2.369638 1.797895
H -1.143063 -1.386282 2.585356
H 0.627550 -1.677144 2.760679
H -5.370263 4.150055 -0.407740
H -5.794481 4.579803 1.274127
H -4.084675 4.580664 0.754078
H 7.374090 0.544168 0.862570
H 7.498718 1.856988 2.068550
H 6.530245 0.398630 2.429173
H -0.694736 -3.229668 4.263679
H 0.187150 -4.154765 3.001651
H -1.567080 -3.864850 2.827653


