%chk=000006083.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006083

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=000006083-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006083

0 1
P 3.900222 1.693489 0.466080
O 1.239693 -0.571140 0.633906
O -0.593106 -2.990520 -1.472621
O 1.087030 -3.806496 0.415108
O 4.193606 -0.023168 0.694277
O 2.246442 1.754887 0.131762
O 4.501525 2.008845 -1.121075
O 4.558320 2.550716 1.616412
N -0.883312 0.010500 -0.320938
N -1.684817 1.857392 -1.423879
N -2.828207 -0.450636 1.158202
N -4.653640 1.161827 0.812341
N -4.528405 2.931240 -0.749372
C 0.413721 -2.054402 -1.048531
C 1.657664 -2.729295 -0.406521
C -0.052653 -1.093624 0.082233
C 2.307140 -1.612523 0.452451
C 3.547433 -0.992104 -0.209614
C -2.168628 0.253485 0.199529
C -0.652635 1.012845 -1.293925
C -2.643089 1.389716 -0.500477
C -3.950365 1.844118 -0.155136
C -4.067588 0.076968 1.403216
H 0.700284 -1.475751 -1.943180
H 2.348667 -3.138201 -1.167836
H -0.597220 -1.642210 0.873008
H 2.571613 -1.983598 1.458761
H 3.302179 -0.529793 -1.186529
H 4.303444 -1.782496 -0.368481
H -0.626980 -3.714564 -0.789093
H 1.783060 -4.441707 0.710262
H 0.289575 1.101466 -1.829436
H -4.666087 -0.430337 2.165306
H -4.018737 3.454339 -1.458391
H -5.462250 3.213714 -0.458856
H 1.713218 0.939087 0.463946
H 5.347884 2.524632 -1.124311


