%chk=000128362.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128362

0 1
 O    3.701500      -2.447900      -1.483000    
 O    4.691200     -0.3471000       2.489500    
 O    6.846700     -0.1148000       1.818600    
 O   -1.212700       2.588200       1.380400    
 O    4.294700       4.218200     -0.9074000    
 O    5.487300       2.992100      -2.398000    
 N   -2.355600      -2.914300      0.4215000    
 N    3.739100     -0.9566000      0.2922000    
 N   -4.802900       2.889100     -0.3718000    
 N   -2.787000       3.914200      0.3736000    
 N   -4.486500       5.140500     -0.6753000    
 N   -4.079700      -2.831300      -2.532800    
 C   -3.081600      -2.212300       1.457300    
 C    5.125100     -0.5701000      0.1571000    
 C   -3.538900     -0.8761000      0.9767000    
 C    5.319200      0.6159000     -0.7954000    
 C   -1.000200      -2.657200      0.1807000    
 C   -2.718500      0.2399000       1.140300    
 C   -3.154600       1.487100      0.6851000    
 C    1.700400      -2.147700     -0.2979000    
 C   -4.404400       1.625600      6.8099998E-02
 C   -3.065900      -3.918200     -0.3698000    
 C   -4.785100     -0.7467000      0.3629000    
 C    4.649500       1.929500     -0.3718000    
 C  -0.4755000      -2.824200      -1.100900    
 C  -0.1746000      -2.235700       1.223000    
 C    3.108500      -1.882300     -0.5473000    
 C   -5.217700      0.5006000     -9.0700001E-02
 C   0.8748000      -2.569400      -1.340200    
 C    1.175600      -1.981000      0.9837000    
 C    5.672300     -0.3320000       1.549500    
 C   -2.308900       2.702800      0.8407000    
 C   -3.965100       3.966600     -0.1921000    
 C    4.860200       3.064700      -1.350400    
 C   -3.630800      -3.310300      -1.575900    
 H   -2.532500      -2.117500       2.399800    
 H   -3.965300      -2.793700       1.756200    
 H    5.667100      -1.436100     -0.2424000    
 H    4.947800      0.3382000      -1.790600    
 H    6.395200      0.7998000     -0.9128000    
 H   -1.754200      0.1415000       1.629300    
 H    3.193400     -0.4574000      0.9872000    
 H   -2.405800      -4.755700     -0.6275000    
 H   -3.875500      -4.362700      0.2216000    
 H   -5.435800      -1.608000      0.2372000    
 H    5.050100       2.249100      0.5966000    
 H    3.569100       1.777300     -0.2727000    
 H   -1.073400      -3.143800      -1.946700    
 H  -0.5218000      -2.125600       2.244200    
 H   -6.191700      0.5864000     -0.5656000    
 H    1.263500      -2.699900      -2.346900    
 H    1.791000      -1.690900       1.830300    
 H   -5.706500       2.987700     -0.8181000    
 H    5.043700     -0.1749000       3.388600    
 H   -5.400800       5.173200      -1.112800    
 H   -3.970500       6.011000     -0.6072000    
 H    4.444300       4.961100      -1.530300    


%chk=000128362-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128362

0 1
O 3.929361 -2.533683 -1.097903
O 4.643286 0.757071 2.318176
O 6.892673 0.518259 1.786694
O -4.162827 2.122627 3.900379
O 4.796781 3.538109 -2.596373
O 6.016216 1.749543 -3.435826
N -2.420766 -3.013757 0.222079
N 3.763666 -0.751034 0.369305
N -4.470277 3.241694 -0.035832
N -4.576979 3.793089 2.311891
N -4.970408 5.433249 0.703167
N -3.733306 -3.395864 -3.033042
C -3.289167 -2.280855 1.166462
C 5.207646 -0.500212 0.303587
C -3.556997 -0.812389 0.820659
C 5.652949 0.225838 -1.005639
C -1.057084 -2.684600 0.077742
C -3.756910 0.123375 1.854394
C -4.062849 1.474969 1.574369
C 1.740647 -2.063557 -0.149996
C -4.165437 1.889244 0.217594
C -2.997910 -4.115262 -0.553447
C -3.656684 -0.374578 -0.528376
C 4.984749 1.599578 -1.184034
C -0.240796 -3.307875 -0.915919
C -0.442655 -1.725532 0.939949
C 3.207200 -1.813292 -0.330835
C -3.958093 0.963306 -0.834530
C 1.126050 -3.005452 -1.013191
C 0.925843 -1.429197 0.824697
C 5.699298 0.278018 1.518799
C -4.266423 2.466272 2.685478
C -4.666128 4.126920 1.026771
C 5.341132 2.244389 -2.508479
C -3.403229 -3.737009 -1.938349
H -2.868276 -2.340934 2.190869
H -4.255466 -2.818832 1.200759
H 5.728040 -1.478552 0.301295
H 5.395821 -0.437340 -1.848077
H 6.752214 0.329515 -0.988758
H -3.682259 -0.156341 2.912758
H 3.214850 -0.184516 1.016111
H -2.290078 -4.963790 -0.618292
H -3.896570 -4.495061 -0.035078
H -3.487862 -1.082981 -1.345974
H 5.263646 2.308590 -0.380603
H 3.881854 1.505842 -1.141373
H -0.668725 -4.011965 -1.635452
H -1.029964 -1.205309 1.699635
H -4.028677 1.284350 -1.880599
H 1.753423 -3.490152 -1.768365
H 1.343415 -0.701839 1.531615
H -4.541473 3.556272 -1.004793
H 5.010657 1.266239 3.089938
H -5.069132 5.775129 -0.248889
H -5.109031 6.066519 1.487643
H 5.042322 3.932654 -3.477189


