%chk=000122035.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122035

0 1
 P    2.930900      -1.955300      0.7999000    
 P    3.656700      0.6022000     -0.5007000    
 P    1.561000       1.851800      -2.135500    
 O   -1.400900      -2.120800       1.021800    
 O   -3.591500      -2.391600      -1.808900    
 O   -2.686600      -4.506900     -0.3583000    
 O    1.389900      -2.462100       1.010300    
 O   -1.723300       4.253700      0.8403000    
 O    2.647700     -0.5321000      5.2900001E-02
 O    3.555200      -1.673100       2.149300    
 O    3.606700      -2.887100     -0.1824000    
 O    2.661900       1.791200     -0.9536000    
 O    4.341900       1.180200      0.8445000    
 O    4.619000      0.1368000      -1.553300    
 O   0.4532000      0.7745000      -1.662100    
 O   0.8331000       3.274600      -1.895200    
 O    2.113400       1.638900      -3.514000    
 N   -2.593000     -0.2040000      0.2301000    
 N   -3.281600       1.818100     -0.1830000    
 N  -0.5698000      0.3777000       1.530200    
 N  -0.2548000       2.751300       1.759900    
 N    1.247300       1.197300       2.698500    
 C   -2.528400      -1.664200      0.2495000    
 C   -2.355900      -2.258000      -1.137400    
 C   -1.699900      -3.587100     -0.8256000    
 C  -0.7757000      -3.226600      0.3320000    
 C   0.6073000      -2.786100     -0.1270000    
 C   -1.698200      0.6596000      0.8130000    
 C   -3.551900      0.5189000     -0.3723000    
 C   -2.129200       1.934700      0.5533000    
 C   -4.091500       2.908400     -0.6848000    
 C   -1.410500       3.081200       1.026200    
 C   0.1175000       1.503600       1.982600    
 H   -3.442400      -2.019100      0.7417000    
 H   -1.691600      -1.634500      -1.746500    
 H   -1.201500      -4.039100      -1.687800    
 H  -0.6840000      -4.039300       1.061200    
 H   0.5455000      -1.899400     -0.7646000    
 H    1.096000      -3.592000     -0.6833000    
 H   -4.397500      0.1216000     -0.9106000    
 H   -4.155900      -2.985200      -1.285000    
 H   -2.226300      -5.330500     -0.1225000    
 H  -0.2109000     -0.5466000       1.746600    
 H   -4.949100       2.514200      -1.237000    
 H   -4.452900       3.508000      0.1550000    
 H   -3.489600       3.527600      -1.355500    
 H    1.839000       1.926200       3.082000    
 H    1.530600      0.2362000       2.855100    
 H    5.062900       1.840300      0.7642000    
 H  -0.2941000      0.5646000      -2.261800    
 H   0.1623000       3.580400      -2.542300    


%chk=000122035-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000122035

0 1
P 2.845953 -1.870633 1.148121
P 2.473671 0.866633 -0.478762
P 0.265143 0.774326 -2.750450
O -1.622483 -2.103685 1.007918
O -3.745395 -2.064936 -1.893740
O -2.911537 -4.256894 -0.765904
O 1.049100 -1.946161 1.013677
O -0.927632 4.369459 1.690336
O 3.126078 -0.686215 -0.169648
O 2.964568 -1.190678 2.603642
O 3.508209 -3.233708 0.692777
O 0.867944 0.484158 -1.093610
O 2.330377 1.798747 0.799453
O 3.324035 1.427781 -1.799212
O 1.524008 1.393717 -3.565561
O 0.029459 -0.888976 -3.244378
O -1.177431 1.438023 -2.593388
N -2.110050 0.094851 0.189998
N -2.426561 2.281085 -0.117001
N -0.258694 0.249398 1.885450
N 0.119355 2.483716 2.615030
N 1.493906 0.712282 3.398468
C -2.498556 -1.366300 0.145294
C -2.432230 -1.973513 -1.296145
C -1.774906 -3.366499 -1.038837
C -0.882871 -3.134291 0.196067
C 0.503932 -2.604308 -0.183212
C -1.227217 0.758876 1.049019
C -2.780840 1.048087 -0.540967
C -1.456422 2.130160 0.885583
C -2.765062 3.543847 -0.813878
C -0.779673 3.118714 1.697819
C 0.488042 1.144419 2.636791
H -3.531731 -1.420597 0.535594
H -1.800451 -1.373166 -1.970340
H -1.198028 -3.706967 -1.918668
H -0.807669 -4.008422 0.862113
H 0.461803 -1.870520 -1.008226
H 1.167037 -3.444094 -0.469923
H -3.479097 0.824578 -1.341031
H -4.111531 -2.957812 -1.633534
H -2.646360 -5.206117 -0.820649
H 0.123160 -0.735735 1.702759
H -3.846621 3.575656 -1.018184
H -2.474732 4.386994 -0.171190
H -2.195814 3.559680 -1.758302
H 2.069231 1.419970 3.863280
H 2.065992 -0.206074 3.123964
H 0.706695 3.144937 3.132632
H 2.715801 1.498155 -2.683446
H 0.686595 -1.178849 -3.928499


