%chk=000030470.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030470

2 1
 P   8.5400000E-02 -0.1026000      0.2152000    
 O   0.2419000       1.306900     -0.5807000    
 O  -1.2000000E-02  0.1216000       1.706200    
 N   -3.384000      -3.920100     -7.9499997E-02
 N    5.140500     -0.9482000     -1.4100000E-02
 N   -1.214800     -0.8652000     -0.4866000    
 N    1.417400     -0.9885000     -0.2540000    
 C   -2.865000      -2.644100     -0.7265000    
 C    3.806400      -1.421100     -0.4578000    
 C   -1.758800      -2.064600      0.1389000    
 C    2.734500     -0.5713000      0.2037000    
 C   -2.256900      -4.938900      8.9999996E-03
 C   -4.517900      -4.489800     -0.9197000    
 C   -3.896300      -3.607600       1.319100    
 C    5.370600      0.5101000     -0.4349000    
 C    5.267500      -1.028900       1.513700    
 C    6.256000      -1.803700     -0.6308000    
 C  -0.5035000       2.434300     -0.3622000    
 C   -1.818600       2.323900      8.9400001E-02
 C   5.1899999E-02   3.693100     -0.5917000    
 C   -2.578400       3.472400      0.3115000    
 C  -0.7080000       4.841600     -0.3697000    
 C   -2.023000       4.731200      8.2099997E-02
 C   -2.834800       5.959400      0.3192000    
 H   -3.708600      -1.949400     -0.8210000    
 H   -2.507400      -2.904300      -1.730400    
 H    3.705300      -2.477400     -0.1789000    
 H    3.765900      -1.345800      -1.551700    
 H   -2.119000      -1.770100       1.127300    
 H  -0.9284000      -2.762300      0.2648000    
 H    2.838400      0.4863000     -4.7699999E-02
 H    2.738100     -0.6716000       1.291700    
 H   -2.696600      -5.904500      0.2802000    
 H   -1.545900      -4.653800      0.7880000    
 H   -1.771200      -5.014300     -0.9684000    
 H   -5.318000      -3.745300     -0.9702000    
 H   -4.880300      -5.406300     -0.4448000    
 H   -4.131000      -4.706300      -1.919800    
 H   -4.442800      -4.484800       1.681100    
 H   -4.570100      -2.747500       1.263900    
 H   -3.059800      -3.418800       1.996400    
 H    5.128200      0.6066000      -1.497200    
 H    4.761700       1.179200      0.1774000    
 H    6.426000      0.7482000     -0.2676000    
 H    4.956300      -2.027200       1.834800    
 H    6.317200     -0.8603000       1.775500    
 H    4.661900     -0.2492000       1.982100    
 H    6.108300      -2.838300     -0.3078000    
 H    6.180800      -1.725500      -1.719300    
 H    7.222800      -1.427200     -0.2840000    
 H   -1.144500      -1.007600      -1.493800    
 H    1.458800      -1.199000      -1.251100    
 H   -2.285500       1.364500      0.2785000    
 H    1.076000       3.784700     -0.9429000    
 H   -3.601300       3.373900      0.6650000    
 H  -0.2635000       5.816700     -0.5504000    
 H   -2.701500       6.304800       1.349200    
 H   -2.540700       6.765000     -0.3622000    
 H   -3.899800       5.768700      0.1482000    


%chk=000030470-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000030470

2 1
P 0.762880 -1.434452 -0.868510
O 0.899004 0.288881 -0.554211
O 0.264491 -2.271757 0.401248
N -3.678137 -2.462062 -0.496763
N 5.164176 -0.142444 0.752806
N -0.290308 -1.774874 -2.192255
N 2.357254 -1.604362 -1.508321
C -2.621469 -1.680173 -1.313250
C 4.083111 -1.107496 0.203021
C -1.524004 -2.553630 -1.982139
C 3.497775 -0.732801 -1.187119
C -4.509786 -3.365672 -1.405684
C -4.597160 -1.430742 0.165565
C -3.007621 -3.300194 0.603319
C 6.321723 0.000509 -0.236374
C 4.563255 1.234767 1.044939
C 5.699959 -0.732394 2.062635
C -0.213956 1.012993 0.000240
C -0.731896 0.695132 1.275384
C -0.720251 2.095939 -0.748902
C -1.776951 1.492301 1.801217
C -1.756641 2.882457 -0.200088
C -2.302090 2.599776 1.082793
C -3.381098 3.484329 1.677749
H -2.148408 -0.986377 -0.597153
H -3.175469 -1.086207 -2.061345
H 3.271500 -1.121977 0.951585
H 4.544148 -2.110118 0.171060
H -1.278378 -3.419786 -1.344088
H -1.850807 -2.934325 -2.964246
H 4.247820 -0.862702 -1.986321
H 3.152117 0.313060 -1.204401
H -5.242637 -3.912322 -0.792540
H -3.849205 -4.085036 -1.911528
H -5.034810 -2.747053 -2.149797
H -4.003469 -0.824226 0.866769
H -5.397673 -1.958114 0.706213
H -5.034748 -0.783983 -0.610175
H -3.759979 -3.528893 1.373042
H -2.164908 -2.732974 1.028354
H -2.631769 -4.240232 0.175293
H 6.709811 -0.999072 -0.485383
H 5.969543 0.508449 -1.145664
H 7.117202 0.600474 0.231391
H 3.716496 1.116734 1.737672
H 5.338263 1.867878 1.503245
H 4.217803 1.697312 0.109948
H 4.863799 -0.864667 2.765799
H 6.172267 -1.704495 1.854828
H 6.442461 -0.042063 2.491096
H -0.104445 -1.373255 -3.113262
H 2.543996 -2.457293 -2.039349
H -0.319721 -0.143229 1.845795
H -0.293653 2.327597 -1.729868
H -2.166317 1.268359 2.801441
H -2.139561 3.735847 -0.771214
H -2.948746 4.433045 2.048029
H -4.148173 3.754840 0.930756
H -3.886710 3.002469 2.531419


