%chk=000084326.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084326

0 1
 P   0.1278000     -0.1938000      -1.292900    
 N    1.592400     -0.3571000     -0.4172000    
 N  -0.9435000      -1.338200     -0.5991000    
 C    2.504100      0.7921000     -0.5387000    
 C    2.308200      -1.625600     -0.6301000    
 C  -0.8909000      -1.431700      0.8690000    
 C   -2.333200      -1.234700      -1.073600    
 C    3.671400      0.6953000      0.4462000    
 C    3.470000      -1.791600      0.3523000    
 C   -1.696400      -2.624500       1.389300    
 C   -3.180000      -2.421900     -0.6089000    
 C    4.431500     -0.6134000      0.2803000    
 C   -3.139100      -2.574700      0.9054000    
 C  -0.5051000       1.309000     -0.4720000    
 C  -0.1776000       1.561200      0.8572000    
 C   -1.312400       2.195600      -1.179100    
 C  -0.6612000       2.709400       1.484300    
 C   -1.795800       3.343900     -0.5520000    
 C   -1.470200       3.600900      0.7798000    
 H    2.036400       1.766300     -0.3695000    
 H    2.910900      0.8364000      -1.559900    
 H    2.691300      -1.684700      -1.658500    
 H    1.642500      -2.487000     -0.4909000    
 H   -1.333300     -0.5555000       1.352400    
 H   0.1259000      -1.560500       1.254800    
 H   -2.364800      -1.220500      -2.171300    
 H   -2.811600     -0.3104000     -0.7240000    
 H    3.292800      0.7739000       1.473200    
 H    4.355400       1.537800      0.2923000    
 H    4.008300      -2.720900      0.1341000    
 H    3.076400      -1.881900       1.372800    
 H   -1.676500      -2.636200       2.485200    
 H   -1.228100      -3.557800       1.051600    
 H   -2.810900      -3.341900      -1.080000    
 H   -4.216400      -2.288400     -0.9388000    
 H    4.948500     -0.6189000     -0.6870000    
 H    5.198500     -0.7048000       1.057000    
 H   -3.669100      -3.484800       1.206600    
 H   -3.656300      -1.729000       1.374800    
 H   0.4482000      0.9088000       1.459100    
 H   -1.578300       2.013700      -2.217500    
 H  -0.4078000       2.910200       2.521200    
 H   -2.426000       4.038000      -1.100400    
 H   -1.846600       4.495000       1.268100    


%chk=000084326-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000084326

0 1
P -0.123218 0.137604 -1.282686
N 1.464569 -0.239804 -0.414318
N -1.128045 -1.090600 -0.456077
C 2.562353 0.726615 -0.699668
C 1.934464 -1.642548 -0.582449
C -1.265232 -1.139443 1.016279
C -2.304961 -1.600670 -1.195619
C 3.717802 0.515626 0.304194
C 3.059235 -1.937188 0.433134
C -1.573636 -2.581182 1.483478
C -2.617357 -3.056891 -0.781769
C 4.231130 -0.942558 0.255841
C -2.809379 -3.153266 0.749851
C -0.504392 1.762766 -0.352763
C -0.037276 2.061713 0.951710
C -1.361767 2.682795 -1.007539
C -0.423537 3.260485 1.591506
C -1.753330 3.882329 -0.367388
C -1.284928 4.172482 0.935026
H 2.172146 1.756579 -0.618094
H 2.956311 0.597703 -1.738862
H 2.321890 -1.820846 -1.617694
H 1.073963 -2.315701 -0.425880
H -2.077872 -0.456784 1.362051
H -0.316808 -0.790826 1.461064
H -2.093418 -1.537452 -2.279239
H -3.207321 -0.972528 -0.995053
H 3.348914 0.748334 1.322474
H 4.537382 1.224809 0.075089
H 3.410308 -2.979750 0.302247
H 2.644343 -1.847549 1.456211
H -1.735165 -2.582286 2.579416
H -0.693015 -3.220939 1.275440
H -1.775399 -3.705476 -1.093952
H -3.525373 -3.403231 -1.313308
H 4.716070 -1.124581 -0.726099
H 5.003535 -1.107543 1.031291
H -2.990115 -4.201789 1.054635
H -3.709752 -2.572601 1.041400
H 0.639339 1.354586 1.445913
H -1.719338 2.462851 -2.021841
H -0.055038 3.483834 2.599620
H -2.414409 4.587611 -0.884197
H -1.584271 5.102411 1.432230


