%chk=000121218.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121218

0 1
 P   -1.023300     -0.1340000      -1.063100    
 O  -0.3089000       1.263100      -1.483700    
 O   0.2631000      -1.083600     -0.7859000    
 O   -1.877000     -0.6747000      -2.180400    
 N   -1.781700      0.1016000      0.3889000    
 C   -2.906000       1.035000      0.3964000    
 C   -2.129000      -1.097900       1.148200    
 C   0.6657000       1.815900     -0.6075000    
 C    1.665300      0.7900000     -0.1514000    
 C    1.419900     -0.5850000     -0.2464000    
 C   -3.270100       1.453800       1.805800    
 C   -3.333400      -1.800000      0.5560000    
 C    2.871300       1.216900      0.4217000    
 C    2.364800      -1.515200      0.1894000    
 C    3.815900      0.2896000      0.8655000    
 C    3.563600      -1.075500      0.7466000    
 H   -2.590200       1.943500     -0.1317000    
 H   -3.778100      0.6704000     -0.1562000    
 H   -1.278900      -1.790000       1.137100    
 H   -2.287600     -0.8846000       2.210400    
 H   0.1570000       2.256100      0.2564000    
 H    1.173400       2.615700      -1.156200    
 H   -3.804400      0.6722000       2.354100    
 H   -2.386500       1.749100       2.382300    
 H   -3.937300       2.322300       1.768900    
 H   -4.266400      -1.248500      0.7030000    
 H   -3.217200      -2.020400     -0.5079000    
 H   -3.467000      -2.764200       1.060700    
 H    3.083700       2.278500      0.5231000    
 H    2.171200      -2.580900      0.1022000    
 H    4.748400      0.6332000       1.303700    
 H    4.299800      -1.796200       1.090300    


%chk=000121218-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121218

0 1
P -0.873435 0.793617 -0.265715
O -0.055465 1.680341 0.997623
O 0.076127 -0.731491 -0.195208
O -0.931730 1.496078 -1.685977
N -2.389266 0.347214 0.373056
C -3.608505 0.495461 -0.465430
C -2.521300 -0.223610 1.734124
C 1.168099 1.104768 1.644042
C 2.074279 0.355299 0.692402
C 1.491661 -0.580818 -0.199787
C -4.447518 1.732551 -0.088265
C -2.575279 -1.766011 1.749219
C 3.478866 0.506043 0.688563
C 2.270309 -1.369644 -1.065398
C 4.280724 -0.287072 -0.164858
C 3.676256 -1.226250 -1.033826
H -3.293645 0.566530 -1.521326
H -4.207011 -0.430437 -0.360422
H -1.677357 0.138439 2.349572
H -3.438414 0.200762 2.186451
H 0.823356 0.435706 2.459047
H 1.671415 1.979464 2.085713
H -4.748274 1.712785 0.975041
H -3.873384 2.657144 -0.270170
H -5.368235 1.768091 -0.700006
H -3.428373 -2.142415 1.156422
H -1.647879 -2.186180 1.324472
H -2.693882 -2.134949 2.785271
H 3.947147 1.236682 1.359083
H 1.775065 -2.067768 -1.746362
H 5.369141 -0.168522 -0.157300
H 4.296606 -1.835608 -1.699750


