%chk=000073311.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000073311

0 1
 O    1.956000       1.013700       1.273700    
 O    1.359300      0.3164000      -1.585700    
 O    1.588000       3.689100     -0.3186000    
 O   -1.389100     -0.8196000       2.732100    
 O   0.8526000     -0.7581000       3.024300    
 O    5.562100       2.721900      0.2345000    
 O   -1.309500      -2.586000     -0.3355000    
 O   -4.241100      -2.754900      0.5927000    
 O   -6.729400      -1.583100      0.4935000    
 O    6.987800      -1.457100      -1.050700    
 O    4.555800      -3.411400      0.3251000    
 O   -5.866100       1.053400      2.8600000E-02
 O   -6.398300       2.798500      -1.375300    
 N    3.976700       1.012100      0.1174000    
 N   -1.294800     -0.3204000      0.1580000    
 N    6.259300      0.6330000     -0.4060000    
 N   -3.317800      -2.201300      -2.090700    
 N   -5.869900       3.159300      0.8333000    
 C   0.6728000       1.035900      0.6247000    
 C   0.9436000       1.439800     -0.8196000    
 C    2.100100       2.404700     -0.6615000    
 C    2.869000       1.832800      0.5255000    
 C  -7.0000002E-03 -0.3084000      0.8102000    
 C  -0.1215000     -0.6437000       2.287900    
 C    3.741100     -0.3283000     -0.1644000    
 C    5.279200       1.544900      1.0000000E-03
 C   -1.846200      -1.480300     -0.3690000    
 C   -3.225100      -1.245400     -0.9884000    
 C   -4.354500      -1.433900      4.8400000E-02
 C    4.681300      -1.198200     -0.5536000    
 C   -5.775800      -1.281100     -0.5269000    
 C    6.078600     -0.7104000     -0.6984000    
 C    4.404900      -2.636900     -0.8519000    
 C   -6.048000      0.1320000      -1.042200    
 C   -6.074100       2.371200     -0.2724000    
 H   9.3300000E-02   1.825300       1.122800    
 H   5.7599999E-02   1.879500      -1.288600    
 H    2.710600       2.509400      -1.564500    
 H    3.231000       2.624000       1.191700    
 H   0.5930000      -1.123300      0.3889000    
 H   -1.846100      0.5332000      0.1635000    
 H    1.574400      0.6362000      -2.478400    
 H    2.349300       4.278600     -0.1818000    
 H    2.744000     -0.7140000     -2.3300000E-02
 H   -3.255100     -0.2311000      -1.401400    
 H   -4.205800     -0.7554000      0.8961000    
 H    7.204600      0.9951000     -0.4961000    
 H   -5.956500      -2.010000      -1.323100    
 H   -1.415900      -1.039300       3.687700    
 H   -4.187200      -2.057300      -2.601800    
 H   -2.571500      -2.022400      -2.762500    
 H    5.072700      -3.026500      -1.627000    
 H    3.378600      -2.765300      -1.214800    
 H   -5.387700      0.3855000      -1.877800    
 H   -7.089800      0.1972000      -1.378700    
 H   -4.345100      -3.385500     -0.1405000    
 H   -6.609800     -0.9364000       1.210100    
 H    4.357100      -4.333600      8.9199997E-02
 H   -5.601700       2.758100       1.725600    
 H   -5.980500       4.166800      0.7918000    


%chk=000073311-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000073311

0 1
O 1.211261 0.441642 0.356148
O 0.348017 0.046235 -2.770617
O 1.649008 3.197585 -1.877758
O -1.311369 -1.104043 1.929735
O 0.427854 -2.424730 1.142081
O 4.208263 3.096001 -0.731662
O -2.129921 -2.683499 -2.084243
O -5.929603 -2.546864 -0.361226
O -6.755681 -0.262609 0.902443
O 7.418458 0.056375 0.804227
O 6.302124 -1.892776 2.613545
O -3.927958 1.025790 0.590274
O -4.356997 3.015290 1.792282
N 3.490965 1.025979 0.106274
N -2.114379 -0.760496 -0.755082
N 5.786835 1.545152 0.044440
N -4.779586 -2.560778 -2.614454
N -2.578960 1.572859 2.342903
C -0.058796 0.555077 -0.408778
C 0.322280 1.137046 -1.800040
C 1.726492 1.780086 -1.597562
C 2.093712 1.496815 -0.102071
C -0.692652 -0.858310 -0.429245
C -0.432282 -1.559082 0.915273
C 3.793678 -0.236579 0.628158
C 4.485459 1.962376 -0.224784
C -2.729037 -1.694309 -1.563102
C -4.240992 -1.450844 -1.800101
C -5.049014 -1.390913 -0.425597
C 5.087703 -0.637182 0.863781
C -5.933965 -0.125330 -0.296994
C 6.188478 0.291230 0.592422
C 5.459465 -2.000546 1.418331
C -5.176276 1.201879 -0.198630
C -3.678450 1.979459 1.626188
H -0.717827 1.265308 0.130823
H -0.384499 1.932536 -2.101787
H 2.458530 1.257166 -2.248062
H 1.946308 2.428672 0.484048
H -0.199980 -1.468477 -1.202809
H -2.699331 -0.067067 -0.250873
H 0.421648 0.417746 -3.684315
H 2.543347 3.577635 -1.637007
H 2.926949 -0.872071 0.823212
H -4.352956 -0.481851 -2.325674
H -4.366333 -1.433361 0.441888
H 6.531877 2.215126 -0.175196
H -6.585511 -0.069988 -1.202502
H -1.141020 -1.622606 2.762506
H -5.255146 -2.266012 -3.472036
H -4.031688 -3.248973 -2.807794
H 5.976141 -2.593886 0.634050
H 4.556422 -2.547525 1.733945
H -4.875838 1.571629 -1.196015
H -5.800657 1.963902 0.297446
H -5.803410 -2.960895 -1.301190
H -7.050009 -1.214887 0.919429
H 7.141477 -1.434901 2.332831
H -2.171314 0.639143 2.212250
H -2.277814 2.164649 3.113475


