%chk=000170963.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000170963

0 1
 P   -3.361400       1.746600      0.4359000    
 P   -4.257900      -1.024300      2.0700000E-02
 O   0.5975000       1.005100      0.8243000    
 O    1.802100       2.873400      -2.000400    
 O   -1.856700       2.340100      0.4227000    
 O    3.547400      -1.791900       1.310200    
 O   -3.172400      0.1537000      0.2340000    
 O   -3.997100       2.225700     -0.9725000    
 O   -4.173900       2.121700       1.641200    
 O   -3.362500      -2.369200      6.4099997E-02
 O   -5.050500      -1.052000       1.428900    
 O   -5.121000     -0.8675000      -1.196300    
 N    1.654600     -0.9934000      0.2593000    
 N    3.381800       2.235400      0.1844000    
 N    2.263300      -3.325400      0.2372000    
 N    4.570800       1.972900      0.4285000    
 N   0.9442000      -4.891300     -0.8656000    
 N    5.664300       1.743100      0.6573000    
 C    1.458400       1.730300      -1.246700    
 C    2.610100       1.155600     -0.4463000    
 C   0.4404000       2.039700     -0.1615000    
 C    1.878800      0.3761000      0.6385000    
 C  -0.9920000       2.054300     -0.6646000    
 C   0.5358000      -1.296400     -0.4985000    
 C    2.542400      -2.029900      0.6376000    
 C   0.2504000      -2.535300     -0.8944000    
 C    1.203200      -3.597100     -0.4778000    
 H    1.074600      0.9821000      -1.948300    
 H    3.265200      0.5383000      -1.074000    
 H   0.6574000       2.995000      0.3333000    
 H    2.409700      0.3983000       1.596800    
 H   -1.285900       1.113900      -1.132600    
 H   -1.120000       2.845600      -1.411000    
 H    2.540200       2.627300      -2.583500    
 H  -0.1432000     -0.5159000     -0.7840000    
 H  -0.6221000      -2.781900      -1.484600    
 H   -4.334100       3.143300      -1.052800    
 H   0.1301000      -5.133900      -1.420400    
 H    1.567300      -5.647700     -0.6039000    
 H   -3.790400      -3.231300     -0.1251000    
 H   -5.831500      -1.638100       1.522800    


%chk=000170963-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170963

0 1
P -3.296051 2.063169 0.484882
P -3.949171 -0.809111 -0.588967
O -0.091144 0.724636 0.125760
O 1.927343 2.961824 -2.006662
O -2.157565 3.034522 -0.306610
O 3.400796 -1.262374 0.962404
O -3.811927 0.960536 -0.745183
O -4.494053 3.248284 0.663896
O -2.976134 1.247543 1.830005
O -2.823284 -1.299190 -1.790463
O -3.074901 -1.161115 0.800628
O -5.422439 -1.333731 -0.791389
N 1.206028 -1.297629 0.178816
N 3.106035 1.889770 0.098098
N 2.443764 -3.362893 0.476148
N 4.135855 1.503193 0.736017
N 1.449683 -5.395784 -0.030316
N 5.121298 1.346497 1.364868
C 1.308935 1.761285 -1.498229
C 2.239952 0.891131 -0.594376
C 0.116035 2.034047 -0.541558
C 1.247093 0.166751 0.386263
C -1.152301 2.453626 -1.253220
C 0.100749 -1.980901 -0.280531
C 2.433673 -1.990287 0.571240
C 0.135913 -3.358602 -0.385305
C 1.351307 -4.025882 0.023202
H 0.971405 1.174563 -2.370883
H 2.842276 0.161760 -1.159306
H 0.409709 2.799333 0.205120
H 1.549418 0.357430 1.432451
H -1.604982 1.618312 -1.817866
H -0.932224 3.299610 -1.924241
H 2.604666 3.238459 -1.323999
H -0.782032 -1.396336 -0.538453
H -0.742505 -3.901972 -0.736541
H -5.103426 3.098869 1.432949
H 0.676330 -5.978668 -0.338107
H 2.321225 -5.822543 0.280733
H -3.241759 -1.605490 -2.636026
H -2.926192 -0.357641 1.437652


