%chk=000145439.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145439

0 1
 P  -1.9300001E-02 -0.9628000      0.6612000    
 N   -1.166200     -0.1492000     -0.2127000    
 N    1.114700      0.2437000      0.6611000    
 C  -0.6594000       1.116900     -0.5247000    
 C   0.5986000       1.326400     -5.9599999E-02
 C   -2.490600     -0.6620000     -0.4602000    
 C    2.440500      8.9500003E-02   1.206300    
 C   0.6479000      -2.174000     -0.5530000    
 C   -3.535800      0.1480000      0.3021000    
 C    3.486000      8.5699998E-02  9.4300002E-02
 C   -1.507900       2.075000      -1.300600    
 C    1.438900       2.550800     -0.2453000    
 C   -4.956000     -0.3891000      0.1070000    
 C    4.907800     -0.1226000      0.6220000    
 C  -0.2518000      -3.386300     -0.7141000    
 C   -5.964900      0.3972000      0.9298000    
 C    5.917500     -0.1872000     -0.5135000    
 H   -2.705600     -0.6389000      -1.535400    
 H   -2.582100      -1.711800     -0.1558000    
 H    2.648600      0.9049000       1.910200    
 H    2.528200     -0.8359000       1.791300    
 H   0.8152000      -1.702600      -1.527500    
 H    1.622300      -2.521300     -0.1920000    
 H   -3.536200       1.197200      2.4000001E-03
 H   -3.291200      0.1347000       1.372400    
 H    3.479900       1.018600     -0.4717000    
 H    3.253400     -0.7086000     -0.6256000    
 H  -0.8847000       2.776200      -1.866200    
 H   -2.134700       1.567200      -2.039300    
 H   -2.137600       2.669100     -0.6329000    
 H    2.067400       2.462500      -1.135500    
 H    2.065800       2.758300      0.6267000    
 H   0.8096000       3.437300     -0.3807000    
 H   -5.230200     -0.3354000     -0.9529000    
 H   -4.998400      -1.444100      0.4014000    
 H    5.175200      0.6958000       1.300400    
 H    4.957400      -1.053500       1.198500    
 H  -0.4910000      -3.850900      0.2486000    
 H   -1.189500      -3.132900      -1.216800    
 H   0.2489000      -4.139500      -1.332200    
 H   -5.734200      0.3348000       1.998100    
 H   -6.972200     -2.2000000E-03  0.7761000    
 H   -5.970300       1.452800      0.6400000    
 H    5.694000      -1.017500      -1.191000    
 H    6.926100     -0.3362000     -0.1154000    
 H    5.915300      0.7407000      -1.094100    


%chk=000145439-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000145439

0 1
P -0.053907 -1.602734 -0.356905
N -1.385815 -0.590978 -1.079564
N 1.027134 -0.149515 -0.284999
C -0.844519 0.689787 -1.478385
C 0.451034 0.922407 -1.061822
C -2.763085 -0.663650 -0.527857
C 1.874426 0.123871 0.899712
C 0.602283 -2.347619 -2.002865
C -2.975013 0.095222 0.805776
C 3.392153 0.055957 0.608850
C -1.708902 1.580098 -2.336469
C 1.318632 2.112452 -1.389538
C -4.437770 0.037780 1.300275
C 4.246994 0.307797 1.871959
C -0.377216 -3.387455 -2.580201
C -4.648483 0.782515 2.636696
C 5.763861 0.232681 1.592860
H -3.462586 -0.272801 -1.293880
H -3.015516 -1.732504 -0.391795
H 1.622009 1.115669 1.332938
H 1.628149 -0.626128 1.678478
H 0.760610 -1.504579 -2.698853
H 1.585975 -2.798325 -1.769129
H -2.663507 1.151354 0.674610
H -2.302403 -0.338068 1.574205
H 3.651300 0.796912 -0.172549
H 3.628377 -0.940604 0.185001
H -1.155104 2.473815 -2.666906
H -2.063129 1.043900 -3.238349
H -2.607458 1.933412 -1.792096
H 2.179035 1.822840 -2.024821
H 1.733724 2.578712 -0.475165
H 0.746070 2.890192 -1.920917
H -5.104332 0.471523 0.526210
H -4.745019 -1.022187 1.415852
H 3.997031 1.303621 2.293060
H 3.976874 -0.434787 2.651014
H -0.536736 -4.232396 -1.883222
H -1.357177 -2.918406 -2.785574
H 0.002954 -3.805274 -3.530824
H -4.016896 0.348543 3.434575
H -5.701170 0.727530 2.970584
H -4.378801 1.851203 2.541124
H 6.044240 -0.762231 1.198531
H 6.355043 0.412436 2.509751
H 6.066036 0.986809 0.841824


