%chk=000083862.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083862

0 1
 P    4.479800       1.629200      6.2300000E-02
 O    1.017000     -0.7489000       1.053500    
 O  -0.7355000      -2.891200      -1.239900    
 O    1.262500      -3.718500      0.4059000    
 O    3.509200      0.4657000      0.6332000    
 O    3.638100       2.263400      -1.164400    
 O    5.647700      0.7934000     -0.6808000    
 O    4.959500       2.614100       1.088000    
 N   -1.083200     -6.7500003E-02  0.1845000    
 N   -1.718300       2.020100     -0.2812000    
 N   -3.259500      -1.109000      0.4687000    
 N   -5.064300      0.4999000      0.1363000    
 N   -4.655800       2.795800     -0.4014000    
 C   0.2271000      -1.939200     -0.8354000    
 C    1.534100      -2.567300     -0.3934000    
 C  -0.1975000      -1.204100      0.4267000    
 C    2.132500      -1.481400      0.4954000    
 C    3.012500     -0.5046000     -0.2719000    
 C   -2.449800     -7.0400000E-02  0.2133000    
 C  -0.6922000       1.211600     -0.1163000    
 C   -2.823100       1.231900     -7.8199998E-02
 C   -4.187400       1.502400     -0.1124000    
 C   -4.553300     -0.7255000      0.4074000    
 H   0.3998000      -1.241800      -1.663300    
 H    2.169500      -2.880400      -1.226800    
 H  -0.7131000      -1.861500       1.137700    
 H    2.689400      -1.897000       1.342800    
 H    2.437100      7.0000002E-03  -1.049500    
 H    3.849100      -1.035800     -0.7361000    
 H  -0.8430000      -3.535100     -0.5192000    
 H    2.117400      -4.068100      0.7104000    
 H   0.3468000       1.497900     -0.2079000    
 H   -5.283600      -1.503800      0.6014000    
 H   -4.003600       3.545500     -0.5878000    
 H   -5.651900       2.967100     -0.4210000    
 H    3.998600       3.046300      -1.632600    
 H    6.422400       1.276500      -1.039400    


%chk=000083862-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000083862

0 1
P 3.900239 1.693458 0.466142
O 1.239648 -0.571274 0.634049
O -0.593069 -2.990460 -1.472770
O 1.086992 -3.806520 0.415070
O 4.193625 -0.023214 0.694157
O 2.246415 1.754915 0.132070
O 4.501343 2.008881 -1.121079
O 4.558495 2.550597 1.616444
N -0.883287 0.010482 -0.320884
N -1.684695 1.857479 -1.423730
N -2.828273 -0.450723 1.158119
N -4.653663 1.161788 0.812258
N -4.528306 2.931308 -0.749324
C 0.413749 -2.054385 -1.048564
C 1.657663 -2.729328 -0.406545
C -0.052671 -1.093693 0.082255
C 2.307150 -1.612572 0.452432
C 3.547348 -0.992064 -0.209737
C -2.168626 0.253455 0.199534
C -0.652529 1.012912 -1.293772
C -2.643029 1.389741 -0.500425
C -3.950322 1.844134 -0.155133
C -4.067665 0.076876 1.403089
H 0.700348 -1.475664 -1.943157
H 2.348672 -3.138246 -1.167849
H -0.597302 -1.642334 0.872948
H 2.571754 -1.983674 1.458697
H 3.301966 -0.529641 -1.186568
H 4.303356 -1.782424 -0.368793
H -0.627000 -3.714545 -0.789290
H 1.783022 -4.441667 0.710367
H 0.289717 1.101569 -1.829213
H -4.666206 -0.430458 2.165127
H -4.018590 3.454439 -1.458285
H -5.462164 3.213777 -0.458846
H 1.713180 0.939127 0.464240
H 5.347715 2.524648 -1.124435


