%chk=000016374.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016374

0 1
 O   0.9836000      0.4901000       1.595900    
 O   -1.093500      0.1056000     -3.8100000E-02
 O   0.1146000       1.608700      -1.290700    
 N   -4.725800      0.2436000     -0.6493000    
 C    1.282800      9.8499998E-02  0.2405000    
 C    1.308700      -1.428300      0.1401000    
 C    2.620700      0.6973000     -0.2004000    
 C   -3.464000     -0.2125000     -6.7100003E-02
 C   6.5800004E-02  0.7156000     -0.4533000    
 C   -2.293800      0.5688000     -0.6428000    
 C   -5.151700       1.497100     -2.7899999E-02
 C   -5.759100     -0.7799000     -0.4958000    
 C    1.725400      -2.192000       1.230600    
 C    2.825400       1.037900      -1.537600    
 C   0.9152000      -2.056500      -1.041600    
 C    3.635100      0.9027000      0.7348000    
 C   0.9008000       1.897200       1.703900    
 C   -6.429800       2.018200     -0.6630000    
 C   -6.046700      -1.054000      0.9706000    
 C    1.748900      -3.583800       1.139200    
 C    4.044500       1.583800      -1.939500    
 C   0.9386000      -3.448200      -1.132800    
 C    4.854200       1.448700      0.3327000    
 C    1.355400      -4.211800     -4.2300001E-02
 C    5.058700       1.789200      -1.004500    
 C   0.5861000       2.263900       3.138600    
 H   -3.285200      -1.271700     -0.2982000    
 H   -3.444400     -0.1375000       1.028100    
 H   -2.235300      0.4160000      -1.727600    
 H   -2.384700       1.640600     -0.4400000    
 H   -5.256500       1.444500       1.061600    
 H   -4.395200       2.268200     -0.2122000    
 H   -6.679700     -0.5192000      -1.028400    
 H   -5.423100      -1.708700     -0.9750000    
 H    2.044500      -1.726100       2.158700    
 H    2.085000      0.8412000      -2.306300    
 H   0.5975000      -1.483400      -1.908300    
 H    3.512500      0.6255000       1.778300    
 H   7.8000002E-02   2.328100       1.125100    
 H    1.815700       2.426600       1.429700    
 H   -6.596900       3.055600     -0.3518000    
 H   -7.314100       1.452500     -0.3543000    
 H   -6.370000       2.013500      -1.756900    
 H   -6.766700      -1.879200       1.034100    
 H   -6.514800     -0.2112000       1.486600    
 H   -5.169700      -1.378000       1.537600    
 H    2.075400      -4.178400       1.987400    
 H    4.209200       1.836300      -2.982900    
 H   0.6348000      -3.937400      -2.053700    
 H    5.646300       1.603200       1.059400    
 H    1.374700      -5.295300     -0.1138000    
 H    6.009400       2.210100      -1.318300    
 H   0.4991000       3.347800       3.258400    
 H    1.370700       1.898400       3.809500    
 H  -0.3513000       1.797800       3.460300    


%chk=000016374-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000016374

0 1
O 1.382555 1.052807 1.779129
O -1.099967 0.255119 -0.122320
O -0.099258 2.291401 -0.595563
N -4.807841 0.224293 -0.634615
C 1.275258 0.463403 0.408275
C 1.108410 -1.052627 0.626741
C 2.544079 0.757328 -0.413193
C -3.450138 -0.294021 -0.341724
C -0.011445 1.105109 -0.189206
C -2.420577 0.827611 -0.533656
C -5.455861 0.845860 0.548678
C -5.660623 -0.700283 -1.422557
C 0.738751 -1.571383 1.889628
C 2.546482 1.382845 -1.682469
C 1.296193 -1.942220 -0.459406
C 3.780498 0.341547 0.149805
C 1.751795 2.488333 1.870573
C -6.670876 1.721123 0.190333
C -6.127024 -1.992256 -0.696348
C 0.564012 -2.962880 2.063706
C 3.762971 1.580884 -2.378560
C 1.112697 -3.330977 -0.287416
C 4.992346 0.548390 -0.538327
C 0.745586 -3.848250 0.976865
C 4.988002 1.168086 -1.811636
C 1.796339 2.816560 3.362928
H -3.209260 -1.117300 -1.037987
H -3.353274 -0.707573 0.687971
H -2.365059 1.153527 -1.586340
H -2.633344 1.711325 0.094347
H -5.757280 0.082336 1.309462
H -4.697077 1.484492 1.039863
H -6.545320 -0.138613 -1.775091
H -5.092142 -0.978298 -2.330602
H 0.599580 -0.880820 2.724826
H 1.611352 1.735852 -2.125345
H 1.594867 -1.551366 -1.438900
H 3.777318 -0.145627 1.131571
H 1.002906 3.104395 1.338096
H 2.737900 2.647136 1.392403
H -7.033252 2.253984 1.088521
H -7.513028 1.123182 -0.201951
H -6.391203 2.468014 -0.573475
H -6.716903 -2.624818 -1.385731
H -6.764176 -1.763522 0.177433
H -5.264823 -2.588161 -0.344135
H 0.283684 -3.354940 3.048280
H 3.749545 2.065151 -3.361533
H 1.262039 -4.008546 -1.135848
H 5.937072 0.222715 -0.088621
H 0.608793 -4.927194 1.113259
H 5.928016 1.325705 -2.352430
H 2.081700 3.874995 3.505980
H 2.535028 2.182203 3.883120
H 0.809276 2.655665 3.830495


