%chk=000114074.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000114074

0 1
 P    1.410300      0.4493000     -0.4731000    
 P   -1.319200     -0.6698000      0.1018000    
 O  -0.1575000      0.4564000     -4.6799999E-02
 O    1.581500     -0.1379000      -1.854000    
 O  -0.9844000      -1.632800       1.215800    
 N    2.212700     -0.3565000      0.7499000    
 N   -2.722400      0.2113000      0.3729000    
 N    1.879700       2.057600     -0.3626000    
 N   -1.485000      -1.357700      -1.411000    
 C    2.350200      -1.810000      0.6708000    
 C   -2.722000       1.128300       1.516900    
 C    1.981600      5.0500002E-02   2.133300    
 C   -3.986000     -0.5317000      0.3618000    
 C    1.305200       2.985800      -1.340700    
 C    3.316000       2.325100     -0.2427000    
 C   -1.658900     -0.4859000      -2.571700    
 C  -0.6457000      -2.500000      -1.762800    
 C    3.517200      -2.297600       1.512600    
 C   -3.873400       2.115600       1.429600    
 H    1.430500      -2.324700      0.9612000    
 H    2.555500      -2.091600     -0.3679000    
 H   -2.751100      0.5803000       2.465900    
 H   -1.789900       1.704400       1.511900    
 H    2.860400     -0.1106000       2.764600    
 H    1.120200     -0.4636000       2.571300    
 H    1.773500       1.124000       2.192700    
 H   -3.983600      -1.278000     -0.4396000    
 H   -4.847600      0.1087000      0.1523000    
 H   -4.146100      -1.070300       1.302100    
 H    1.507800       4.027600      -1.070000    
 H   0.2167000       2.871000      -1.370700    
 H    1.693800       2.795200      -2.346500    
 H    3.508300       3.388600     -6.1900001E-02
 H    3.848800       2.020500      -1.149800    
 H    3.752500       1.788200      0.6040000    
 H  -0.7338000      2.6200000E-02  -2.845500    
 H   -2.414800      0.2789000      -2.368200    
 H   -2.015500      -1.050100      -3.440300    
 H  -0.6518000      -3.233600     -0.9501000    
 H   0.3910000      -2.221500      -1.951500    
 H   -1.032800      -3.017100      -2.647800    
 H    4.428900      -1.724900       1.310400    
 H    3.304000      -2.257100       2.585100    
 H    3.729300      -3.345500       1.272600    
 H   -3.935900       2.578900      0.4390000    
 H   -4.837700       1.657700       1.669900    
 H   -3.719700       2.920700       2.156800    


%chk=000114074-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000114074

0 1
P 1.429617 0.372042 -0.362348
P -1.364992 -0.839251 0.144802
O -0.281254 0.561022 0.057386
O 1.598261 -0.366490 -1.774601
O -0.805252 -1.941785 1.163918
N 2.273827 -0.436303 0.917018
N -2.814417 0.058709 0.470520
N 1.875415 2.040559 -0.158219
N -1.634307 -1.495079 -1.434173
C 2.600433 -1.878485 0.728838
C -2.789981 1.263397 1.337821
C 2.022284 -0.004559 2.311040
C -4.105495 -0.656445 0.390448
C 0.975996 3.115635 -0.621354
C 3.315327 2.374715 -0.189992
C -1.923208 -0.581398 -2.559746
C -0.929177 -2.744061 -1.801304
C 4.009608 -2.221298 1.246279
C -3.422019 2.490372 0.648983
H 1.828198 -2.491737 1.236965
H 2.535889 -2.090618 -0.353327
H -3.325738 1.040656 2.285588
H -1.741482 1.488074 1.592967
H 2.939127 -0.139915 2.911638
H 1.197969 -0.593055 2.762376
H 1.755670 1.065332 2.324572
H -4.021368 -1.502481 -0.311631
H -4.886086 0.027270 0.009515
H -4.426694 -1.043041 1.380444
H 1.123567 4.003798 0.022199
H -0.070246 2.786899 -0.531626
H 1.177548 3.409400 -1.673832
H 3.494345 3.250656 0.461697
H 3.668449 2.619807 -1.214247
H 3.905132 1.526826 0.196093
H -0.987015 -0.248536 -3.052287
H -2.475088 0.300755 -2.194124
H -2.554224 -1.109626 -3.298651
H -0.726000 -3.328037 -0.888687
H 0.029006 -2.524479 -2.312967
H -1.579454 -3.337936 -2.470360
H 4.775146 -1.619903 0.724723
H 4.107809 -2.044868 2.332801
H 4.222452 -3.290854 1.063377
H -2.864995 2.741035 -0.270887
H -4.477711 2.310827 0.376272
H -3.394071 3.364753 1.326086


