%chk=000020069.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020069

0 1
 O    1.753100       1.959400       1.786100    
 O    1.421700      -1.710600     -0.4267000    
 O   -1.511600       2.155700      -1.962000    
 O   -1.887300      -1.490300       1.935000    
 O    2.184500      -3.876300     -0.2591000    
 N    3.793200       1.798900     -0.3184000    
 N   0.7954000       1.444000     -0.3408000    
 N   -4.143100      -1.022200      0.5060000    
 N    1.943900      -2.856600      -2.305800    
 C    2.964900      0.6880000      0.1521000    
 C    1.630900      0.9520000      0.7825000    
 C    2.915200       1.143300      -1.270900    
 C    1.551400       1.695700      -1.563700    
 C   0.7912000     -0.2431000       1.349700    
 C  -0.4749000      0.9247000     -0.2475000    
 C  -0.5607000      2.6000000E-03  0.7090000    
 C    1.308900      -1.631900      0.9819000    
 C   -1.612500       1.301300      -1.088500    
 C   -1.819500     -0.6751000       1.020500    
 C    2.402000       1.457800       2.944100    
 C   -2.906100      0.5914000     -0.8111000    
 C   -3.011600     -0.3287000      0.1729000    
 C   -4.036800       1.006500      -1.714700    
 C    1.876900      -2.900300     -0.9352000    
 C   -5.369200     -0.3860000      0.9046000    
 H    3.505800     -0.1928000      0.4519000    
 H    3.364600      0.5513000      -2.052400    
 H    4.753200       1.483300     -0.4528000    
 H    1.589100       2.767900      -1.780700    
 H    1.111900       1.171400      -2.419100    
 H   0.6524000     -0.2015000       2.432900    
 H   0.6168000      -2.405400       1.336400    
 H    2.283400      -1.809300       1.451600    
 H    3.124400      0.6611000       2.741800    
 H    1.664700       1.125600       3.680300    
 H    2.946100       2.290300       3.401400    
 H   -4.482300       1.941600      -1.361300    
 H   -4.818300      0.2452000      -1.782800    
 H   -3.685600       1.157200      -2.741500    
 H   -3.967100      -1.916100      0.9586000    
 H   -5.184000      0.5412000       1.457400    
 H   -5.934200      -1.055600       1.561400    
 H   -6.005000     -0.1663000      4.3099999E-02
 H    1.679300      -2.023400      -2.820600    
 H    2.261300      -3.654700      -2.845400    


%chk=000020069-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000020069

0 1
O 1.775675 1.822851 1.818300
O 1.025087 -2.170977 -0.308211
O -1.404165 2.101742 -2.022939
O -2.089637 -1.561618 2.053016
O 3.304041 -2.796491 -0.438465
N 3.812177 1.623161 -0.234286
N 0.778709 1.336203 -0.256258
N -4.228410 -0.736905 0.823686
N 1.832502 -3.002260 -2.254394
C 2.938406 0.405225 0.070733
C 1.636284 0.748035 0.818482
C 2.876584 1.070430 -1.296212
C 1.552865 1.845411 -1.413181
C 0.746692 -0.405318 1.428874
C -0.504978 0.883206 -0.151626
C -0.628419 -0.061980 0.866667
C 1.144897 -1.866110 1.142476
C -1.641474 1.303157 -1.038600
C -1.885619 -0.641931 1.166055
C 2.846472 1.597834 2.794401
C -2.959911 0.765961 -0.727736
C -3.096250 -0.139376 0.340859
C -4.091215 1.248305 -1.624072
C 2.162307 -2.676510 -0.958546
C -5.626502 -0.603237 0.414560
H 3.406984 -0.573315 0.202128
H 3.293192 0.580143 -2.181387
H 4.789131 1.314005 -0.412246
H 1.722142 2.931995 -1.321665
H 1.000187 1.648440 -2.344284
H 0.764768 -0.295467 2.530207
H 0.425192 -2.530611 1.648968
H 2.174360 -2.096553 1.470437
H 3.838230 1.631965 2.307751
H 2.723760 0.635720 3.336309
H 2.760103 2.427316 3.513148
H -4.727060 2.006807 -1.128730
H -4.741092 0.428401 -1.973748
H -3.644138 1.735414 -2.506530
H -3.992742 -1.402514 1.583114
H -5.896573 0.449376 0.238293
H -6.266338 -0.991104 1.225192
H -5.852457 -1.179735 -0.503397
H 0.874139 -2.899348 -2.580566
H 2.548495 -3.398543 -2.856377


