%chk=000000711.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000711

0 1
 P    5.669900     -1.8200001E-02   1.618300    
 O   0.4897000       1.992000      0.1433000    
 O    2.380000      0.5670000      -2.659500    
 O    4.304100       2.341400      -1.719400    
 O    4.928400       1.085300      0.7003000    
 O   -5.319600      0.7641000       1.935100    
 O   -3.426300       4.439200     -7.8299999E-02
 O    5.984800      -1.226300      0.5905000    
 O    4.460100     -0.6019000       2.518800    
 O    6.850400      0.4881000       2.394300    
 N   -1.452900      0.1664000     -0.7934000    
 N   -3.430800     -0.9134000      0.8394000    
 N   -2.493500       2.368600     -0.4083000    
 N   -4.387200       2.615300      0.9370000    
 C   0.8552000       1.005300     -0.8225000    
 C  -0.3817000      0.6611000      -1.660700    
 C    2.022100       1.538400      -1.677500    
 C   -1.461900      -1.246900     -0.5481000    
 C   -2.445600      0.9986000     -0.2089000    
 C    3.272000       1.880900     -0.8448000    
 C   -2.477800      -1.783000      0.2877000    
 C   -3.393000      0.4353000      0.5815000    
 C  -0.5215000      -2.142800      -1.087100    
 C    3.799000      0.6771000     -6.5200001E-02
 C   -2.532700      -3.156400      0.5607000    
 C  -0.5852000      -3.511900     -0.8087000    
 C   -1.587400      -4.017600      1.2600000E-02
 C   -4.456000       1.264000       1.218400    
 C   -3.434000       3.225700      0.1341000    
 C   0.4400000      -4.418600      -1.409600    
 C   -1.668500      -5.476700      0.3202000    
 H    1.166300      0.1040000     -0.2859000    
 H  -0.7206000       1.570300      -2.172600    
 H  -0.1580000     -1.4800000E-02  -2.492200    
 H    1.706000       2.440500      -2.216000    
 H    3.052900       2.703700     -0.1545000    
 H   -4.160600      -1.279700       1.436100    
 H   0.2936000      -1.803100      -1.717600    
 H    3.048400      0.2859000      0.6238000    
 H    4.115100     -0.1157000     -0.7503000    
 H   -3.320100      -3.543100       1.204100    
 H   -1.774000       2.784000     -0.9895000    
 H  -7.5300001E-02   1.557700      0.8043000    
 H    3.116200      0.9340000      -3.178300    
 H    5.082900       2.539600      -1.171600    
 H   -5.095100       3.213600       1.353200    
 H    1.157300      -3.870400      -2.030400    
 H    1.013700      -4.924100     -0.6261000    
 H  -3.6100000E-02  -5.166000      -2.052700    
 H   -2.512800      -5.706400      0.9796000    
 H   -1.809200      -6.057400     -0.5973000    
 H  -0.7605000      -5.814800      0.8299000    
 H    6.495100      -2.000600      0.9103000    
 H    4.666800      -1.237300       3.236900    


%chk=000000711-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000000711

0 1
P 6.234552 1.037855 1.560753
O 0.725808 2.246044 -0.060721
O 2.233875 -0.384190 -2.223291
O 4.315538 1.327285 -2.362724
O 5.325955 1.330367 0.144153
O -5.658414 0.745059 1.732983
O -2.506977 4.230042 1.386029
O 5.880166 -0.623955 1.757223
O 5.282155 1.689353 2.853215
O 7.727076 1.545216 1.485093
N -1.449455 0.008977 -0.525824
N -3.921663 -1.029243 0.329201
N -2.009048 2.137698 0.454956
N -4.083901 2.488150 1.506640
C 0.918443 0.923608 -0.707905
C -0.423059 0.592059 -1.400256
C 2.052017 0.992124 -1.749889
C -1.663694 -1.427869 -0.513944
C -2.358331 0.816769 0.176036
C 3.399156 1.541824 -1.231605
C -2.934488 -1.934532 -0.096647
C -3.576818 0.310800 0.604580
C -0.662269 -2.327114 -0.924642
C 3.933254 0.805858 0.003948
C -3.155837 -3.327277 -0.136212
C -0.890540 -3.730410 -0.975038
C -2.159105 -4.234342 -0.578825
C -4.517948 1.142012 1.319974
C -2.849758 3.039635 1.132987
C 0.213222 -4.659919 -1.448282
C -2.455807 -5.722708 -0.622963
H 1.149940 0.148038 0.048516
H -0.804296 1.528994 -1.852582
H -0.221503 -0.115797 -2.221321
H 1.744426 1.651868 -2.589944
H 3.311124 2.624344 -1.012463
H -4.825398 -1.344306 0.685495
H 0.319142 -1.951472 -1.235080
H 3.362547 1.035993 0.923917
H 3.979667 -0.284625 -0.151603
H -4.134054 -3.713672 0.174811
H -1.034069 2.450163 0.268977
H 1.355415 2.384215 0.688188
H 3.052497 -0.373030 -2.789897
H 5.240211 1.499546 -2.045035
H -4.727726 3.113489 1.998682
H 1.123626 -4.095531 -1.713037
H 0.488721 -5.398957 -0.670508
H -0.092487 -5.240324 -2.340841
H -3.478806 -5.940087 -0.272135
H -2.358693 -6.125739 -1.649759
H -1.752605 -6.297339 0.010489
H 6.209757 -1.053777 2.585435
H 5.620561 2.548827 3.214097


