%chk=000000730.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000730

0 1
 P    3.857000      -1.163500      -1.061000    
 P    4.342400     -0.5440000       1.773600    
 O   0.1148000      0.6602000      0.1382000    
 O   -1.275000       3.959100      0.1145000    
 O   0.3537000       3.181000      -2.404200    
 O    2.365100     -0.5382000      -1.054800    
 O    4.603400     -0.4476000      0.1817000    
 O    4.568300     -0.4992000      -2.353200    
 O    3.909300      -2.663500      -1.028400    
 O   -5.693600      -1.848800      0.9225000    
 O    5.566900      0.3062000       2.398000    
 O    4.727400      -2.074400       2.123000    
 O    2.974200     -0.1110000       2.211000    
 N   -2.115600      0.9140000      0.8882000    
 N   -2.151200     -0.8465000     -0.7896000    
 N   -4.065700      0.4150000       1.881200    
 N   -4.087500      -2.264000     -0.6962000    
 N   -2.386000      -2.584000      -2.295700    
 C  -0.9843000       2.694100     -0.4539000    
 C   0.3900000       2.663100      -1.088000    
 C  -0.8606000       1.609700      0.6104000    
 C   0.6997000       1.174600      -1.070600    
 C    2.186700      0.8685000      -1.083700    
 C   -2.637000     -0.1566000      0.2456000    
 C   -3.021300       1.226300       1.877300    
 C   -3.821200     -0.4533000      0.8549000    
 C   -4.627600      -1.564100      0.3899000    
 C   -2.932100      -1.913000      -1.230800    
 H   -1.764000       2.470300      -1.192400    
 H    1.107100       3.249300     -0.5018000    
 H  -0.5024000       2.009400       1.566900    
 H   0.2270000      0.6606000      -1.916000    
 H    2.673700       1.300700     -0.2043000    
 H    2.653700       1.276200      -1.985500    
 H   -2.127900       3.883100      0.5753000    
 H  -0.2768000       2.654600      -2.924400    
 H   -2.865900       2.052300       2.558000    
 H   -1.266400     -0.6441000      -1.237600    
 H   -2.856400      -3.380800      -2.710900    
 H   -1.497600      -2.305300      -2.697400    
 H    4.381900     -0.8720000      -3.241000    
 H    5.586400      0.4709000       3.364800    
 H    4.574400      -2.406700       3.033100    


%chk=000000730-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000000730

0 1
P 2.998005 -1.146492 -1.648386
P 3.387368 -0.761562 1.463631
O 0.502453 1.278469 0.354088
O 0.092487 4.164917 1.222353
O -0.893102 3.541663 -2.108343
O 1.817598 0.008240 -2.051137
O 3.819554 -0.564448 -0.231673
O 4.184098 -0.823326 -2.827720
O 2.375157 -2.594430 -1.545574
O -4.905676 -2.414917 -0.349343
O 3.533813 -2.436106 1.737517
O 1.711728 -0.629981 1.357899
O 4.234597 0.203713 2.381003
N -1.866700 1.016888 0.631914
N -0.934438 -1.315189 0.242866
N -4.074354 0.497955 0.272387
N -2.611970 -2.916555 -0.502533
N -0.326705 -3.456382 -0.541899
C -0.747378 3.275311 0.428843
C -0.061216 3.171167 -0.979132
C -0.696119 1.826379 1.007414
C 0.452695 1.706098 -1.075732
C 1.807194 1.458365 -1.721947
C -1.938082 -0.366906 0.369515
C -3.221714 1.476427 0.573745
C -3.292082 -0.662285 0.127217
C -3.707386 -2.038841 -0.240480
C -1.348538 -2.573765 -0.280018
H -1.775509 3.665686 0.323953
H 0.763115 3.901284 -0.982656
H -0.492348 1.793607 2.091787
H -0.292703 1.072658 -1.597666
H 2.651793 1.735347 -1.064566
H 1.876856 2.003345 -2.678093
H -0.377821 4.456688 2.043748
H -1.668615 2.927162 -2.192078
H -3.502845 2.498441 0.814730
H 0.004497 -1.226318 0.655146
H -0.623975 -4.375424 -0.864872
H 0.641359 -3.160530 -0.721383
H 5.003266 -1.380478 -2.787862
H 4.232894 -2.684832 2.395075
H 1.315751 0.267557 0.984963


