%chk=000063900.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063900

0 1
 I    5.455600       2.559800     -0.1321000    
 O   0.1148000       1.569200       1.152000    
 N  -0.4351000     -0.6411000      0.6115000    
 N   -4.078500      0.1389000      0.3848000    
 N    1.213000      -2.071000     -0.3335000    
 C   -1.812900     -0.4801000       1.074000    
 C   -2.700500     -4.6000001E-03 -7.2300002E-02
 C   -4.937600      0.6020000     -0.6954000    
 C   8.0000004E-03  -1.856600      9.3999997E-02
 C   0.4214000      0.4664000      0.7080000    
 C    1.800100      0.2405000      0.2242000    
 C    2.137200      -1.019700     -0.2759000    
 C   -4.453900       1.953400      -1.213700    
 C   -6.376800      0.6893000     -0.1976000    
 C  -0.9750000      -3.001100      2.3399999E-02
 C    2.746900       1.270200      0.2679000    
 C    3.441400      -1.238400     -0.7341000    
 C    4.042200       1.037800     -0.1924000    
 C    4.389700     -0.2151000     -0.6928000    
 H   -2.189100      -1.415100       1.499300    
 H   -1.831800      0.2588000       1.884900    
 H   -2.287700      0.9517000     -0.4096000    
 H   -2.647700     -0.6970000     -0.9193000    
 H   -4.920500     -0.1200000      -1.522000    
 H   -4.417300     -0.7559000      0.7375000    
 H   -5.211300       2.402300      -1.867200    
 H   -4.270900       2.662000     -0.3977000    
 H   -3.545000       1.869700      -1.817800    
 H   -6.731500     -0.2849000      0.1571000    
 H   -7.046800       1.010900      -1.002400    
 H   -6.474000       1.405600      0.6262000    
 H   -1.885800      -2.717900     -0.5053000    
 H   -1.225800      -3.335000       1.034200    
 H  -0.5261000      -3.846400     -0.5082000    
 H    2.474800       2.247700      0.6588000    
 H    3.727000      -2.211100      -1.127600    
 H    5.393800     -0.4178000      -1.056600    


%chk=000063900-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000063900

0 1
I 5.496194 2.624994 -0.538650
O -0.065205 1.639236 0.639304
N -0.400007 -0.685157 0.541924
N -4.098583 0.029429 0.067556
N 1.361297 -2.217449 -0.061931
C -1.825009 -0.442286 0.898487
C -2.689709 -0.101911 -0.340843
C -4.983043 0.855477 -0.803565
C 0.099861 -1.976026 0.278422
C 0.422576 0.487213 0.433790
C 1.825713 0.215646 0.077539
C 2.244284 -1.130704 -0.161220
C -4.690109 2.358341 -0.603821
C -6.450219 0.531122 -0.455127
C -0.837380 -3.156062 0.400225
C 2.745176 1.292620 -0.031342
C 3.601044 -1.377459 -0.512782
C 4.075344 1.016568 -0.374973
C 4.512778 -0.316111 -0.618897
H -2.222175 -1.328613 1.418226
H -1.858443 0.415347 1.588320
H -2.340618 0.863208 -0.744311
H -2.523592 -0.868711 -1.137899
H -4.820698 0.607956 -1.882796
H -4.525013 -0.885375 0.268443
H -5.316339 2.967412 -1.281849
H -4.905699 2.646528 0.440483
H -3.633215 2.604119 -0.810878
H -6.688385 -0.532527 -0.651482
H -7.139145 1.148143 -1.057974
H -6.640162 0.739302 0.613893
H -1.748272 -3.031175 -0.211987
H -1.153350 -3.322221 1.447149
H -0.293083 -4.047063 0.056907
H 2.382241 2.306900 0.158642
H 3.910881 -2.410506 -0.694959
H 5.554362 -0.512803 -0.887722


