%chk=000127764.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127764

0 1
 O    2.019800      -1.356700      4.1999999E-02
 O    2.261000       2.761000      0.3559000    
 O    3.300200      0.5966000       1.725300    
 O    4.194600      -3.019100     -0.2123000    
 O   -1.433800     -0.8303000      -2.195400    
 O  -0.6778000       3.057600      0.8586000    
 O   -2.895100      0.6568000       1.515700    
 O   -4.396900      0.1534000     -0.1062000    
 N  -0.1196000       1.549500     -0.8242000    
 N  -0.2721000      -1.337500     -0.2463000    
 N   -4.119600      -2.425800       1.320600    
 C   0.8980000      0.8161000     -0.1017000    
 C    2.267500       1.484700     -0.2785000    
 C    3.394100      0.6226000      0.2994000    
 C   0.9479000     -0.6437000     -0.5736000    
 C    3.306000     -0.8020000     -0.2574000    
 C    4.354600      -1.727800      0.3473000    
 C   -1.368300      -1.371300      -1.093600    
 C  -0.8193000       2.609500     -0.2761000    
 C   -2.527200      -2.173300     -0.5319000    
 C   -3.000300      -1.625200      0.8170000    
 C   -1.798600       3.208000      -1.249900    
 C   -3.515200     -0.2031000      0.6651000    
 H   0.6334000      0.8482000      0.9644000    
 H    2.453300       1.652000      -1.347500    
 H    4.366800       1.066200      5.7500001E-02
 H    1.080400     -0.6908000      -1.662600    
 H    3.425900     -0.7980000      -1.348800    
 H  -0.2732000       1.313900      -1.800700    
 H    5.367400      -1.375900      0.1306000    
 H    4.238900      -1.825300       1.431600    
 H  -0.2956000      -1.844100      0.6326000    
 H    3.137100       3.160100      0.2185000    
 H    3.322800       1.518300       2.034500    
 H   -2.198300      -3.215100     -0.4319000    
 H   -3.338300      -2.155500      -1.271000    
 H    3.289100      -3.314600     -1.6100001E-02
 H   -2.197600      -1.644300       1.561200    
 H   -2.488000       3.869500     -0.7181000    
 H   -1.256200       3.782900      -2.005300    
 H   -2.379100       2.419600      -1.738000    
 H   -3.823600      -3.395500       1.426800    
 H   -4.376500      -2.104400       2.253500    
 H   -3.235100       1.572100       1.421600    


%chk=000127764-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127764

0 1
O 1.925864 -1.201823 0.267096
O 2.569675 2.923693 -0.249297
O 3.618683 1.003160 1.430566
O 3.963123 -3.132388 0.411916
O -0.797374 -1.917818 -2.237762
O -1.160043 2.285985 1.124370
O -2.159505 0.068560 1.918904
O -3.828257 0.478064 0.342576
N -0.027986 1.831767 -0.847545
N -0.394169 -1.011173 -0.132626
N -4.458930 -2.398104 0.925425
C 1.032001 1.046186 -0.206855
C 2.430223 1.512847 -0.663073
C 3.551474 0.675694 0.010664
C 0.893353 -0.486164 -0.506784
C 3.295485 -0.833036 -0.156869
C 4.218356 -1.718237 0.690238
C -1.183994 -1.703881 -1.048387
C -1.059665 2.413858 -0.147356
C -2.566173 -2.192434 -0.597241
C -3.101462 -1.857432 0.826279
C -2.096111 3.179001 -0.943768
C -3.122239 -0.322764 0.993249
H 0.939090 1.196831 0.883873
H 2.519477 1.415651 -1.768415
H 4.519397 0.921024 -0.486689
H 1.029169 -0.689196 -1.591358
H 3.415726 -1.098607 -1.232395
H 0.002427 1.958886 -1.861523
H 5.273152 -1.544793 0.419832
H 4.070059 -1.471735 1.758496
H -0.732610 -0.822519 0.820860
H 3.277338 3.363279 -0.785842
H 3.432640 1.978621 1.507580
H -2.559903 -3.293177 -0.723960
H -3.297263 -1.798399 -1.326813
H 2.991237 -3.282698 0.546413
H -2.397260 -2.252604 1.593952
H -3.061060 2.651390 -0.833272
H -2.216926 4.184362 -0.506665
H -1.851649 3.274515 -2.015256
H -4.580653 -3.349557 0.574464
H -4.956042 -2.209938 1.797609
H -1.905178 1.064400 1.817988


