%chk=000060236.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060236

0 1
 O   6.3000000E-03 -0.1261000       1.416100    
 N   -1.084200     -0.3071000     -0.6250000    
 N    2.413900     -0.1337000      9.5799997E-02
 C   -2.410300      7.2800003E-02 -0.1623000    
 C   -2.366200       1.532500      0.3641000    
 C   -2.878000     -0.8993000      0.9505000    
 C   -3.372700      3.5399999E-02  -1.363700    
 C   1.3600000E-02 -0.3730000      0.2122000    
 C   -1.884900       2.576300     -0.6384000    
 C   -2.966200      -2.365100      0.5356000    
 C    1.267300     -0.7632000     -0.5433000    
 C    2.277500       1.324600      8.3200000E-02
 C    3.658500     -0.5310000     -0.5665000    
 C    3.468900       1.993300      0.7478000    
 C    3.856300      -2.036200     -0.5061000    
 H   -3.370200       1.822700      0.7017000    
 H   -1.730200       1.600600       1.254100    
 H   -3.874700     -0.5890000       1.292200    
 H   -2.236300     -0.8298000       1.834900    
 H  -0.9699000     -0.5392000      -1.607600    
 H   -3.038600      0.6790000      -2.184200    
 H   -4.382700      0.3453000      -1.074200    
 H   -3.440500     -0.9696000      -1.794300    
 H   -2.588400       2.703600      -1.465600    
 H  -0.9015000       2.328000      -1.047800    
 H   -1.797900       3.548600     -0.1412000    
 H   -2.009900      -2.738000      0.1577000    
 H   -3.731600      -2.525200     -0.2287000    
 H   -3.241700      -2.977100       1.401200    
 H    1.300700      -1.855900     -0.4784000    
 H    1.190300     -0.4815000      -1.600700    
 H    1.394600       1.659700      0.6356000    
 H    2.174600       1.708500     -0.9404000    
 H    4.527900     -0.1092000     -5.2600000E-02
 H    3.693500     -0.1932000      -1.609900    
 H    3.233900       3.046300      0.9419000    
 H    4.361300       1.990600      0.1144000    
 H    3.709600       1.532900       1.712200    
 H    4.882200      -2.284000     -0.8017000    
 H    3.195900      -2.572700      -1.194200    
 H    3.706000      -2.424900      0.5070000    


%chk=000060236-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000060236

0 1
O -0.006465 -0.331286 1.467480
N -1.086892 -0.194262 -0.601888
N 2.487411 -0.104335 -0.169292
C -2.470822 0.121299 -0.128029
C -2.472560 1.450161 0.697585
C -2.999612 -1.024845 0.796164
C -3.348510 0.257834 -1.395110
C 0.017418 -0.417721 0.203310
C -1.935301 2.695547 -0.035554
C -3.026997 -2.432659 0.167371
C 1.283551 -0.839554 -0.582699
C 2.411289 1.342254 -0.498971
C 3.745678 -0.755130 -0.613141
C 3.370101 2.208995 0.338746
C 4.031813 -2.087660 0.106202
H -3.515540 1.631236 1.026630
H -1.868809 1.274000 1.605998
H -4.020338 -0.740062 1.121301
H -2.363849 -1.041769 1.700055
H -0.946754 -0.261188 -1.612695
H -2.990270 1.072630 -2.050495
H -4.389215 0.488240 -1.107818
H -3.359396 -0.678304 -1.982717
H -2.566488 2.988406 -0.894992
H -0.908469 2.522898 -0.407480
H -1.897689 3.557811 0.654781
H -2.023268 -2.725432 -0.191603
H -3.730257 -2.502876 -0.682979
H -3.341963 -3.179848 0.918323
H 1.437301 -1.913461 -0.370727
H 1.087469 -0.754679 -1.688815
H 1.377760 1.672825 -0.284749
H 2.588018 1.524304 -1.592240
H 4.572683 -0.058695 -0.388937
H 3.757384 -0.914743 -1.724371
H 3.197283 3.280541 0.126664
H 4.432394 1.996877 0.121794
H 3.191998 2.026633 1.412174
H 5.035654 -2.460191 -0.169944
H 3.305282 -2.877661 -0.156985
H 3.995180 -1.939432 1.199053


