%chk=000161733.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000161733

0 1
 P    6.190800      -1.564800      0.6103000    
 O    3.080500      0.4779000      -1.591400    
 O    5.202200     -0.3894000       1.149200    
 O    6.174000      -1.447200      -1.010700    
 O    3.996700       2.123100       1.006300    
 O    5.385400      -2.936800      0.9108000    
 O    7.566700      -1.534600       1.212000    
 N   0.9933000      0.7439000     -0.4749000    
 N  -0.7527000     -0.6392000     -0.5781000    
 N  -0.1404000       2.799100      0.1510000    
 N   -3.576400      0.3237000      9.3000000E-03
 N   -2.545700       2.452200      0.3754000    
 C    4.008000     -0.2124000      0.4215000    
 C    4.325600      6.3199997E-02  -1.033200    
 C    3.163600      0.9926000      0.7672000    
 C    2.381100       1.202500     -0.5433000    
 C    4.944600      -1.159800      -1.679200    
 C  -0.1037000       1.494600     -0.1594000    
 C   0.5520000     -0.5300000     -0.7187000    
 C   -1.175300      0.6188000     -0.2286000    
 C   -2.433600       1.140800      5.3900000E-02
 C   -1.408800       3.189000      0.4036000    
 C   -4.895100      0.8082000      0.2908000    
 C   -5.898100     -0.3079000      0.1963000    
 C   -6.516400     -0.5729000      -1.018900    
 C   -6.194600      -1.060500       1.325500    
 C   -7.447100      -1.608200      -1.106400    
 C   -7.125100      -2.096000       1.237800    
 C   -7.751500      -2.369800      2.2000000E-02
 H    3.385800      -1.110700      0.5222000    
 H    5.041600      0.8931000      -1.118500    
 H    2.542000      0.8400000       1.654600    
 H    2.355200       2.256100     -0.8449000    
 H    4.283700      -2.031600      -1.630600    
 H    5.155600     -0.9727000      -2.736700    
 H    3.412700       2.885500       1.159600    
 H    1.218300      -1.337700     -0.9899000    
 H    4.486700      -3.064500      0.5403000    
 H   -1.535800       4.234100      0.6647000    
 H   -3.436500     -0.6498000     -0.2400000    
 H   -5.168300       1.607200     -0.4103000    
 H   -4.936700       1.251000       1.294300    
 H   -6.285400      1.2800000E-02  -1.904300    
 H   -5.711300     -0.8570000       2.277000    
 H   -7.934400      -1.821900      -2.053200    
 H   -7.361800      -2.689400       2.116200    
 H   -8.475800      -3.176200     -4.6300001E-02


%chk=000161733-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000161733

0 1
P 5.616007 -0.503822 1.969033
O 2.800878 -0.626031 -1.520806
O 4.945744 0.854125 1.074806
O 5.389264 -1.864540 0.930503
O 4.329324 2.252766 -1.236193
O 4.404330 -0.823281 3.159529
O 7.084935 -0.256883 2.477667
N 0.975651 0.927260 -1.584485
N -1.189793 1.064297 -2.341586
N 0.520675 0.564013 0.845879
N -3.539904 0.811843 -0.365331
N -1.890550 0.527039 1.328390
C 3.702050 0.474412 0.361908
C 3.978602 -0.664384 -0.639486
C 3.210854 1.605341 -0.554049
C 2.422114 0.822395 -1.652972
C 4.149419 -1.998557 0.087692
C 0.154602 0.761350 -0.456401
C 0.106210 1.092253 -2.683674
C -1.171863 0.856600 -0.948028
C -2.227045 0.732810 0.008082
C -0.569540 0.456315 1.665368
C -4.672230 0.712763 0.569983
C -5.695426 -0.337449 0.148833
C -7.079884 -0.041256 0.189724
C -5.281153 -1.631375 -0.259070
C -8.037005 -1.020826 -0.161384
C -6.234888 -2.609803 -0.614498
C -7.616756 -2.308425 -0.565545
H 2.900633 0.198295 1.070872
H 4.901265 -0.436270 -1.212273
H 2.577389 2.338815 -0.026173
H 2.751778 1.187416 -2.641919
H 3.283602 -2.235465 0.731062
H 4.380542 -2.840420 -0.581150
H 5.054802 2.387365 -0.569753
H 0.485838 1.228409 -3.694411
H 4.588468 -0.441139 4.055146
H -0.359136 0.290577 2.726204
H -3.727909 0.954086 -1.360884
H -5.168467 1.698881 0.666394
H -4.230604 0.469492 1.553474
H -7.411354 0.958803 0.497029
H -4.211131 -1.867047 -0.297605
H -9.105003 -0.778304 -0.125549
H -5.903259 -3.606139 -0.927912
H -8.356474 -3.067904 -0.842142


