%chk=000151837.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000151837

0 1
 P   -4.890300      -1.722900      0.1417000    
 O   -1.569300      0.9077000      0.9187000    
 O   -2.031400       3.832700      4.5699999E-02
 O   -3.983900     -0.4691000      0.6197000    
 O   -4.026200      -2.387600      -1.052800    
 O   -6.113700      -1.008100     -0.6376000    
 O   -5.299700      -2.663000       1.237500    
 N   0.5841000      0.3431000      9.9200003E-02
 N    1.380400      -1.727900     -0.2585000    
 N    2.663700       1.585300      0.3559000    
 N    4.525700      0.1324000      0.1266000    
 N    4.495500      -2.069900     -0.2684000    
 C  -0.3886000       1.415600      0.2736000    
 C   -2.206300       2.594600     -0.6397000    
 C  -0.8439000       2.065300      -1.025200    
 C   -2.726300       1.541400      0.3330000    
 C   -3.555500      0.4657000     -0.3549000    
 C    1.947200      0.4470000      0.1400000    
 C   0.2963000     -0.9834000     -0.1429000    
 C    2.391100     -0.8401000     -8.3400004E-02
 C    3.764100     -0.9983000     -8.8699996E-02
 C    3.960600       1.401200      0.3447000    
 C    5.835200     -0.2516000      7.9999998E-02
 C    5.791100      -1.609900     -0.1642000    
 H   5.8800001E-02   2.150100      0.9536000    
 H   -2.862600       2.777600      -1.494500    
 H  -0.9432000       1.318400      -1.821800    
 H  -0.1428000       2.837100      -1.357600    
 H   -3.297900       1.983800       1.156800    
 H   -2.957500     -6.1299998E-02  -1.105200    
 H   -4.427100      0.9142000     -0.8413000    
 H  -0.7190000      -1.346300     -0.2296000    
 H   -1.573100       3.666500      0.8863000    
 H    4.641700       2.251800      0.5085000    
 H    6.653700      0.4408000      0.2179000    
 H    6.630100      -2.282300     -0.2705000    
 H   -4.345000      -3.219700      -1.462800    
 H   -6.862400      -1.558500     -0.9518000    


%chk=000151837-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000151837

0 1
P -4.432193 -1.890567 0.181289
O -1.663730 1.266242 1.065777
O -2.289827 4.197096 0.178784
O -4.150602 -0.261115 0.575039
O -2.873154 -2.316624 -0.424223
O -5.360361 -1.722723 -1.264988
O -5.041799 -2.810629 1.311742
N 0.352968 0.447654 0.022368
N 0.959395 -1.699789 -0.507668
N 2.587741 1.440025 0.413597
N 4.364763 -0.129873 0.091422
N 4.230699 -2.352685 -0.521080
C -0.449664 1.646106 0.307843
C -2.344591 2.921621 -0.541791
C -0.944106 2.407464 -0.951039
C -2.874757 1.776569 0.360487
C -3.594433 0.681709 -0.429377
C 1.752325 0.399000 0.089577
C -0.068354 -0.838653 -0.335227
C 2.106337 -0.937628 -0.251022
C 3.499130 -1.252262 -0.261616
C 3.885102 1.142578 0.409639
C 5.679649 -0.622191 0.029916
C 5.565660 -1.963567 -0.341265
H 0.185953 2.279850 0.952394
H -2.996009 3.130924 -1.404159
H -1.016597 1.715764 -1.809128
H -0.275801 3.237658 -1.225546
H -3.549626 2.161109 1.143754
H -2.913488 0.153985 -1.122006
H -4.441438 1.107628 -0.998404
H -1.116929 -1.123303 -0.405107
H -1.799424 4.071620 1.032047
H 4.620230 1.909762 0.662549
H 6.542876 0.000044 0.248019
H 6.373448 -2.677211 -0.490238
H -2.566283 -3.238273 -0.235238
H -6.089508 -2.384912 -1.369121


