%chk=000137473.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137473

0 1
 P    8.807800      0.2297000     -8.3200000E-02
 O    8.877000      0.9076000      -1.410200    
 C   0.9318000      0.2397000     -3.2800000E-02
 C    2.184500     -0.6335000      6.8800002E-02
 C  -0.3755000     -0.5571000      3.1900000E-02
 C    3.458200      0.2116000     -2.4400000E-02
 C   -1.624700      0.3098000     -0.1485000    
 C    4.710100     -0.6572000      0.1128000    
 C   -2.930800     -0.4901000     -8.1200004E-02
 C    6.017600      0.1337000      1.6000001E-02
 C   -4.183600      0.3829000     -0.1871000    
 C    7.280600     -0.7115000      0.1202000    
 C   -5.486600     -0.4215000     -0.1294000    
 C   -6.777100      0.4047000     -0.1411000    
 C   -8.079300     -0.3939000     -2.7600000E-02
 C   -9.330600      0.4858000      5.2999998E-03
 C    8.845300       1.346300       1.295200    
 C    10.10980     -0.9442000      0.1909000    
 C   -10.59200     -0.3539000      0.2112000    
 C   -11.84250      0.5109000      0.2133000    
 H   0.9611000      0.7992000     -0.9761000    
 H   0.9385000      0.9817000      0.7751000    
 H    2.171000      -1.180100       1.019400    
 H    2.178100      -1.379900     -0.7346000    
 H  -0.3635000      -1.330600     -0.7458000    
 H  -0.4308000      -1.077800      0.9957000    
 H    3.481200      0.7397000     -0.9852000    
 H    3.455300      0.9736000      0.7643000    
 H   -1.636900       1.084200      0.6285000    
 H   -1.570600      0.8291000      -1.113100    
 H    4.683300      -1.183600       1.074900    
 H    4.701800      -1.426900     -0.6689000    
 H   -2.938000      -1.233600     -0.8877000    
 H   -2.962100      -1.047000      0.8634000    
 H    6.029400      0.8962000      0.8031000    
 H    6.037100      0.6791000     -0.9354000    
 H   -4.154700      0.9509000      -1.124800    
 H   -4.179400       1.116600      0.6283000    
 H    7.306400      -1.215700       1.092700    
 H    7.264600      -1.493700     -0.6472000    
 H   -5.509100      -1.121500     -0.9741000    
 H   -5.478900      -1.035400      0.7802000    
 H   -6.804900      0.9978000      -1.063800    
 H   -6.734600       1.123900      0.6866000    
 H   -8.040500      -1.001500      0.8850000    
 H   -8.146200      -1.092800     -0.8703000    
 H   -9.405800       1.048400     -0.9330000    
 H   -9.243400       1.219200      0.8161000    
 H    8.061900       2.104200       1.210900    
 H    8.704300      0.8118000       2.238900    
 H    9.808200       1.863500       1.340300    
 H    10.09380      -1.724400     -0.5753000    
 H    11.08560     -0.4516000      0.1566000    
 H    10.00630      -1.424900       1.167900    
 H   -10.67500      -1.102400     -0.5854000    
 H   -10.52770     -0.8967000       1.161400    
 H   -11.80570       1.251600       1.018500    
 H   -11.95400       1.041800     -0.7375000    
 H   -12.73190     -0.1092000      0.3624000    


%chk=000137473-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000137473

0 1
P 8.900598 0.192702 -0.227742
O 8.786420 0.896041 -1.682271
C 0.899416 0.302793 0.074257
C 2.172243 -0.567788 0.175926
C -0.407188 -0.522010 0.104113
C 3.482767 0.246311 0.086699
C -1.684401 0.345942 0.044614
C 4.749568 -0.623026 0.253942
C -2.987954 -0.484222 0.047582
C 6.060230 0.176464 0.072063
C -4.267867 0.380915 0.009111
C 7.313232 -0.695702 0.297450
C -5.569661 -0.451985 0.002155
C -6.850888 0.411654 -0.025881
C -8.152065 -0.422393 -0.035976
C -9.433878 0.440628 -0.058318
C 9.289151 1.404902 1.160542
C 10.248360 -1.117397 -0.114890
C -10.734994 -0.394335 -0.069703
C -12.010104 0.476380 -0.089565
H 0.935282 0.897997 -0.862151
H 0.889795 1.036019 0.907863
H 2.153227 -1.131258 1.132620
H 2.160259 -1.328529 -0.632582
H -0.408743 -1.234128 -0.747670
H -0.428898 -1.141196 1.025626
H 3.523295 0.769043 -0.891311
H 3.476286 1.039433 0.863565
H -1.692748 1.044557 0.907504
H -1.655691 0.979304 -0.866804
H 4.735955 -1.099704 1.256694
H 4.725113 -1.450273 -0.485946
H -2.985036 -1.172499 -0.823619
H -3.009323 -1.128825 0.951464
H 6.064833 1.036223 0.773213
H 6.100527 0.601115 -0.950271
H -4.244263 1.030938 -0.890688
H -4.274570 1.063751 0.884587
H 7.416950 -1.003388 1.355610
H 7.252937 -1.614286 -0.318146
H -5.565722 -1.129892 -0.877164
H -5.589620 -1.107293 0.898313
H -6.830426 1.068925 -0.920493
H -6.856085 1.087571 0.854970
H -8.170641 -1.082391 0.856786
H -8.148552 -1.095695 -0.918885
H -9.416631 1.101528 -0.950391
H -9.439422 1.113095 0.825220
H 8.497081 2.170139 1.195269
H 9.353626 0.889877 2.133853
H 10.248623 1.899217 0.937140
H 10.077394 -1.863202 -0.908063
H 11.227780 -0.640025 -0.281551
H 10.240348 -1.614017 0.870237
H -10.729038 -1.064697 -0.953534
H -10.750338 -1.055604 0.820875
H -12.054729 1.132839 0.800089
H -12.031767 1.125689 -0.985319
H -12.925852 -0.143228 -0.098916


