%chk=000097274.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097274

0 1
 P   -1.398600      0.2524000      0.2142000    
 O   -2.456900       1.265700      0.5982000    
 N   -1.681400      -1.255400      0.8660000    
 N   -1.388600     -4.1000000E-03  -1.435200    
 N   0.1929000      0.5579000      0.6187000    
 C   -2.927600      -1.897800      0.4800000    
 C   -2.739100      -1.340300       1.860600    
 C   -2.611100     -0.5446000      -2.005400    
 C   -2.218200      0.8865000      -2.229200    
 C   0.5098000       1.768800       1.375200    
 C    1.288300     -0.2437000      0.2170000    
 C    1.745500      -1.259500       1.052000    
 C    1.901600     -1.2500000E-02  -1.011300    
 C   0.7015000       2.900200      0.4172000    
 C    2.824400      -2.050100      0.6560000    
 C    2.980500     -0.8032000      -1.407400    
 C    3.441700      -1.822000     -0.5737000    
 C    1.835400       3.601700      0.3071000    
 H   -2.877200      -2.972600      0.3597000    
 H   -3.798200      -1.436900      4.3200001E-02
 H   -3.272300     -0.4433000       2.139300    
 H   -2.567100      -2.040300       2.667800    
 H   -3.593300     -0.5621000      -1.562500    
 H   -2.473300      -1.238600      -2.824900    
 H   -1.820800       1.153600      -3.199900    
 H   -2.784700       1.665800      -1.741400    
 H  -0.3160000       2.010200       2.053800    
 H    1.392300       1.617000       2.009500    
 H    1.273100      -1.444600       2.013200    
 H    1.552900      0.7762000      -1.672400    
 H  -0.1399000       3.174800     -0.2145000    
 H    3.183800      -2.843000       1.305300    
 H    3.461000     -0.6258000      -2.365100    
 H    4.281700      -2.437500     -0.8821000    
 H    1.909700       4.417600     -0.4035000    
 H    2.703400       3.375900      0.9165000    


%chk=000097274-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000097274

0 1
P -1.614593 0.060251 -0.056455
O -2.699048 1.056006 0.603207
N -1.793911 -1.674753 0.322270
N -1.611412 0.000075 -1.844126
N 0.020987 0.494649 0.426616
C -3.189641 -2.159845 0.680489
C -2.129040 -2.034287 1.757456
C -2.933672 0.257900 -2.548315
C -1.843616 1.311908 -2.570904
C 0.123735 1.703363 1.289817
C 1.188715 -0.279866 0.116308
C 2.414799 -0.027553 0.794065
C 1.153425 -1.311222 -0.864799
C 0.866068 2.851544 0.629898
C 3.563905 -0.795649 0.503642
C 2.306660 -2.071774 -1.138945
C 3.522860 -1.826537 -0.459268
C 1.764481 3.651782 1.253515
H -3.437310 -3.139989 0.263477
H -3.999129 -1.419067 0.698580
H -2.251312 -1.220070 2.483102
H -1.602378 -2.921806 2.119186
H -3.812097 0.473835 -1.927351
H -3.101487 -0.380263 -3.420382
H -1.218020 1.439566 -3.458721
H -2.016750 2.212432 -1.967891
H -0.916680 2.021428 1.502334
H 0.588497 1.445462 2.261412
H 2.490580 0.772653 1.532768
H 0.231159 -1.509686 -1.417111
H 0.597153 3.038154 -0.420589
H 4.496211 -0.578190 1.037815
H 2.251378 -2.860796 -1.897743
H 4.416600 -2.419414 -0.680867
H 2.229927 4.500358 0.741086
H 2.058159 3.485803 2.298425


