%chk=000099744.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099744

0 1
 P  -8.6700000E-02 -5.9900001E-02  -1.057900    
 N   0.8552000      -1.189300     -0.1902000    
 N   -1.588000      8.9999998E-04 -0.2471000    
 C    2.296000     -0.8963000     -4.6300001E-02
 C   -2.356400      -1.257700     -0.1557000    
 C    2.899000      -1.764200       1.075900    
 C   -3.445900      -1.130500      0.9272000    
 C   0.5744000      -2.608100     -0.4439000    
 C   -2.428400       1.175300     -0.5127000    
 C    2.640500      -3.252400      0.8681000    
 C   -4.354100      7.3899999E-02  0.7053000    
 C    1.155000      -3.503800      0.6528000    
 C   -3.522300       1.338300      0.5451000    
 C    3.109300      -1.042300      -1.344600    
 C   -2.964400      -1.731700      -1.487600    
 C   0.6459000       1.474300     -0.3899000    
 C   0.5887000       1.728700      0.9771000    
 C    1.257200       2.380500      -1.251200    
 C    1.147600       2.900300       1.487600    
 C    1.816200       3.552100     -0.7407000    
 C    1.761400       3.811900      0.6287000    
 H    2.487900      0.1175000      0.3111000    
 H   -1.756700      -2.050400      0.2778000    
 H    2.462200      -1.459700       2.036700    
 H    3.978600      -1.588600       1.156400    
 H   -2.965500      -1.030800       1.910400    
 H   -4.052000      -2.043500      0.9698000    
 H    1.045700      -2.895000      -1.395100    
 H  -0.4581000      -2.899700     -0.6047000    
 H   -2.887200       1.106800      -1.507700    
 H   -1.862300       2.113600     -0.5129000    
 H    2.991100      -3.816600       1.739600    
 H    3.208800      -3.618300      5.4000001E-03
 H   -5.040400      0.1843000       1.552400    
 H   -4.973500     -7.8800000E-02 -0.1859000    
 H   0.9988000      -4.556500      0.3903000    
 H   0.6127000      -3.325500       1.590100    
 H   -4.174900       2.176700      0.2758000    
 H   -3.060000       1.592400       1.507700    
 H    3.080000      -2.056900      -1.752100    
 H    4.161700     -0.7988000      -1.159400    
 H    2.756300     -0.3585000      -2.122900    
 H   -3.659000      -1.004100      -1.917100    
 H   -3.520100      -2.664300      -1.338200    
 H   -2.189200      -1.936800      -2.232800    
 H   0.1243000       1.037100       1.675900    
 H    1.310800       2.196500      -2.321300    
 H    1.106600       3.102000       2.553900    
 H    2.294400       4.261900      -1.409200    
 H    2.197100       4.723800       1.026200    


%chk=000099744-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099744

0 1
P -0.190330 -0.014986 -1.413185
N 0.901366 -1.227157 -0.708795
N -1.504083 0.029883 -0.100746
C 1.554064 -1.107947 0.623276
C -2.101734 -1.298923 0.246086
C 1.529099 -2.491804 1.337999
C -2.920293 -1.131948 1.554443
C 1.422120 -2.289050 -1.597866
C -2.524869 1.094698 -0.314660
C 2.091369 -3.629166 0.450921
C -3.994039 -0.024105 1.437823
C 1.354770 -3.671715 -0.908191
C -3.348212 1.302396 0.976133
C 2.990914 -0.526688 0.536998
C -2.927279 -1.960999 -0.893817
C 0.614077 1.654610 -0.949640
C 0.527906 2.243017 0.336558
C 1.370069 2.302761 -1.957992
C 1.196073 3.456715 0.612576
C 2.043017 3.516744 -1.683526
C 1.958218 4.095122 -0.395468
H 0.932987 -0.409968 1.215904
H -1.246620 -1.967401 0.457280
H 0.481021 -2.732623 1.605327
H 2.100832 -2.422505 2.284335
H -2.217195 -0.866981 2.368453
H -3.388808 -2.100458 1.819314
H 2.477952 -2.087236 -1.891782
H 0.823641 -2.285268 -2.527590
H -3.216850 0.856999 -1.157283
H -2.006329 2.033192 -0.581323
H 1.993313 -4.599158 0.975158
H 3.175255 -3.473758 0.275620
H -4.504354 0.113588 2.410461
H -4.775245 -0.328041 0.711964
H 1.800576 -4.439061 -1.571432
H 0.291647 -3.941650 -0.748348
H -4.122462 2.074808 0.799454
H -2.673332 1.680542 1.769650
H 3.668665 -1.185991 -0.034674
H 3.416310 -0.404886 1.551091
H 2.978250 0.461644 0.047411
H -3.804776 -1.358954 -1.189504
H -3.293896 -2.953639 -0.570891
H -2.299470 -2.104821 -1.792739
H -0.073472 1.741972 1.104850
H 1.431938 1.857557 -2.959315
H 1.124438 3.904186 1.610945
H 2.625090 4.009699 -2.470701
H 2.476973 5.036550 -0.180366


