%chk=000058824.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000058824

0 1
 O  -0.6936000      0.4788000     -0.3397000    
 O   0.7798000     -0.8669000       1.442600    
 O  -0.1560000      -1.293800      -1.707200    
 N   -4.764800      0.2194000      0.5975000    
 C   -2.088800      0.3320000     -0.5714000    
 C   -2.809700       1.578400     -6.7900002E-02
 C   -2.610200     -0.9074000      0.1503000    
 C   -4.326900       1.411600     -0.1428000    
 C   -4.133500     -0.9981000      6.8099998E-02
 C   -6.221900      9.8899998E-02  0.5575000    
 C    1.338100     -0.6853000      0.1366000    
 C   9.8300003E-02 -0.5628000     -0.7574000    
 C    2.199200      0.5753000      0.1116000    
 C    2.156500      -1.889600     -0.2896000    
 C    2.257100       1.314500      -1.049500    
 C    2.887700      0.9297000       1.250900    
 C    2.401200      -2.990500      0.4389000    
 C    3.043500       2.466300      -1.072500    
 C    3.674100       2.081600       1.227800    
 C    3.752000       2.849900      6.6000000E-02
 C    3.217600      -4.141800     -5.0000001E-02
 H   -2.263200      0.2413000      -1.651800    
 H   -2.496200       2.450200     -0.6549000    
 H   -2.504900       1.792000      0.9655000    
 H   -2.293600     -0.8851000       1.201900    
 H   -2.181000      -1.824200     -0.2684000    
 H   -4.790700       2.307100      0.2884000    
 H   -4.639900       1.356200      -1.193800    
 H   -4.436600      -1.175400     -0.9723000    
 H   -4.456300      -1.867300      0.6543000    
 H   -6.693500      0.9843000      0.9981000    
 H   -6.553400     -0.7604000       1.151000    
 H   -6.599800     -2.0900000E-02 -0.4644000    
 H    2.579800      -1.841500      -1.292900    
 H    1.731100       1.028900      -1.954600    
 H    2.849300      0.3391000       2.160700    
 H   0.2355000      -1.673100       1.438500    
 H    2.005000      -3.083100       1.445600    
 H    3.107800       3.062300      -1.978200    
 H    4.228200       2.379000       2.113300    
 H    4.365700       3.745800      4.7600001E-02
 H    3.590000      -3.986200      -1.067400    
 H    4.078400      -4.293800      0.6084000    
 H    2.614400      -5.054700     -4.3900002E-02


%chk=000058824-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000058824

0 1
O -0.838261 -0.114792 0.491420
O 1.315959 -0.838397 1.721526
O -0.064711 -0.611950 -1.654904
N -5.094212 0.028011 0.462951
C -2.229269 0.134426 -0.028708
C -2.899934 1.105995 0.946689
C -2.999700 -1.191484 -0.119139
C -4.370699 1.319685 0.524195
C -4.467109 -0.902565 -0.505656
C -6.538653 0.204939 0.217168
C 1.510978 -0.661241 0.286077
C 0.142283 -0.483659 -0.429288
C 2.373327 0.603368 -0.003965
C 2.208058 -1.899248 -0.278987
C 2.528594 1.102787 -1.321966
C 3.057996 1.230298 1.063861
C 2.579245 -2.962071 0.473560
C 3.353172 2.224414 -1.562656
C 3.882878 2.351090 0.818835
C 4.033283 2.853486 -0.494154
C 3.298869 -4.178168 -0.062178
H -2.121657 0.582085 -1.035905
H -2.363376 2.072061 0.959657
H -2.875071 0.677700 1.965224
H -2.974915 -1.693039 0.865281
H -2.534907 -1.855842 -0.869031
H -4.874602 1.970992 1.261479
H -4.400051 1.853506 -0.463893
H -4.501398 -0.491205 -1.550210
H -5.040233 -1.847574 -0.508343
H -6.975197 0.843063 1.006165
H -7.044813 -0.776220 0.254087
H -6.767474 0.674270 -0.773422
H 2.409852 -1.858969 -1.356608
H 1.998314 0.627244 -2.154846
H 2.939147 0.823740 2.072384
H 0.454984 -0.403968 1.961252
H 2.348333 -2.936436 1.546434
H 3.463260 2.606448 -2.583996
H 4.409617 2.829521 1.652646
H 4.672996 3.723085 -0.682885
H 3.473847 -4.105583 -1.150074
H 4.279289 -4.308647 0.436534
H 2.717764 -5.100454 0.133892


