%chk=000174322.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000174322

0 1
 P    3.437700       1.731400     -0.3160000    
 O   0.6237000      -1.181500       1.173100    
 O  -0.8217000      -3.775800     -0.8368000    
 O    1.359500      -4.060800      0.7754000    
 O    2.776600      0.4560000      0.4309000    
 O   -3.310100      -2.184300     -0.5507000    
 O   -3.640200       3.105200     -0.4851000    
 O    2.383000       2.076300      -1.492500    
 O    4.683500       1.077600      -1.113400    
 O    3.793000       2.878700      0.5838000    
 N   -1.497500     -0.8434000      0.2508000    
 N   -3.365900      0.1887000     -0.4824000    
 N  -0.3028000       1.292000      0.8265000    
 N   -1.511000       3.310600      0.4043000    
 C  -0.5270000      -1.836100      0.6143000    
 C  -3.3700000E-02  -2.631100     -0.5824000    
 C    1.377400      -2.986000     -0.1637000    
 C    1.818000      -1.727700      0.5717000    
 C    2.412100     -0.6697000     -0.3484000    
 C   -1.334800      0.5249000      0.3704000    
 C   -2.796300      -1.105700     -0.2966000    
 C   -2.455300       1.116400     -7.0200004E-02
 C   -2.605100       2.589500     -7.5800002E-02
 C  -0.4629000       2.654900      0.8125000    
 H  -0.9825000      -2.482500       1.373900    
 H  -8.2000000E-03  -2.015400      -1.489800    
 H    2.024600      -3.280000     -0.9940000    
 H    2.513600      -1.944200       1.390400    
 H    1.683500     -0.3505000      -1.099800    
 H    3.297200      -1.066700     -0.8549000    
 H   -1.717600      -3.474400      -1.061500    
 H   0.8681000      -3.782200       1.566100    
 H   -4.284300      0.3966000     -0.8543000    
 H   0.5356000      0.8388000       1.166800    
 H   0.4178000       3.193100       1.196400    
 H    2.534200       2.870800      -2.047400    
 H    5.310100       1.669200      -1.581900    


%chk=000174322-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000174322

0 1
P 3.219289 1.850550 -0.447022
O 0.735755 -1.181979 1.203263
O -0.912153 -3.915210 -0.542759
O 1.358251 -4.192525 0.838342
O 2.744919 0.401954 0.312671
O -3.066234 -2.148138 -0.613380
O -3.595344 3.328354 -0.565126
O 2.281658 1.777646 -1.890402
O 4.800185 1.456152 -0.978756
O 3.040506 3.138786 0.455690
N -1.390750 -0.693357 0.285809
N -3.250085 0.262637 -0.511856
N -0.208305 1.435637 0.931118
N -1.427844 3.463500 0.416401
C -0.494958 -1.785408 0.708305
C -0.106041 -2.717851 -0.477745
C 1.355452 -3.107492 -0.129429
C 1.911686 -1.838804 0.549298
C 2.553712 -0.862944 -0.445285
C -1.255241 0.686430 0.437877
C -2.651191 -0.981139 -0.321433
C -2.404720 1.298484 -0.060742
C -2.568821 2.745277 -0.105431
C -0.365669 2.827968 0.880834
H -0.979439 -2.371338 1.513065
H -0.143508 -2.142787 -1.425701
H 1.926543 -3.387239 -1.038127
H 2.612281 -2.095593 1.359020
H 1.910671 -0.661898 -1.321754
H 3.537936 -1.239747 -0.778903
H -1.867777 -3.610911 -0.632919
H 0.569712 -4.764656 0.622600
H -4.166240 0.406911 -0.934360
H 0.651871 0.971626 1.254782
H 0.492883 3.398085 1.253045
H 1.876601 2.635659 -2.175810
H 5.466709 2.186057 -0.915481


