%chk=000149336.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149336

0 1
 O   -1.904900      -1.622300      0.1468000    
 O    1.210500       2.160100     -0.4305000    
 O    3.990800      -1.732600     -0.1937000    
 O    3.731700       1.024100     -0.2756000    
 O  -0.8561000      -3.378800     -0.9085000    
 O   -2.362500       2.279700       1.378900    
 O   -2.488200      0.1728000       1.997600    
 O    1.094700       2.176100       1.907400    
 O    3.834600      -1.654800       2.140600    
 O    3.815700      0.9398000      -2.613500    
 N   -4.492800     -0.2833000      0.1157000    
 N   -5.427900       1.100300      -1.326500    
 N   -2.873400       1.128900       1.265300    
 C   -4.217700      -1.523200      0.8385000    
 C   -3.132600      -2.358400      0.1723000    
 C   -5.411900     -0.1335000     -0.8731000    
 C   -3.878900      0.9103000      0.3173000    
 C   -4.474100       1.756000     -0.5889000    
 C   -6.264800      -1.243300      -1.345400    
 C   0.3564000      -1.393300     -0.3866000    
 C  -0.8253000      -2.239900     -0.4235000    
 C    1.624400      -1.969400     -0.3086000    
 C   0.2221000     -5.5000000E-03 -0.4271000    
 C    1.355900      0.8062000     -0.3898000    
 C    2.758100      -1.157600     -0.2711000    
 C    2.623900      0.2302000     -0.3117000    
 C    1.084600       2.760800      0.8324000    
 C    4.443500      -1.942300       1.118700    
 C    4.260600       1.325200      -1.540400    
 C   0.9302000       4.245100      0.6808000    
 C    5.802600      -2.576500       1.096800    
 C    5.470800       2.199100      -1.394200    
 H   -5.147300      -2.104800      0.8425000    
 H   -4.037100      -1.320400       1.894200    
 H   -3.416000      -2.611300     -0.8557000    
 H   -2.986000      -3.284600      0.7392000    
 H   -4.269400       2.804600     -0.7526000    
 H   -5.666800      -2.100100      -1.668900    
 H   -6.865300     -0.9207000      -2.202500    
 H   -6.957200      -1.566900     -0.5622000    
 H    1.739000      -3.050300     -0.2738000    
 H  -0.7524000      0.4639000     -0.5193000    
 H    6.238000       1.673000     -0.8207000    
 H    5.872000       2.432400      -2.384400    
 H    5.193100       3.133700     -0.9006000    
 H   2.5000000E-02   4.465000      0.1097000    
 H   0.8403000       4.703300       1.669800    
 H    1.810800       4.658400      0.1828000    
 H    6.510500      -1.913400      0.5934000    
 H    6.143900      -2.738900       2.123000    
 H    5.750800      -3.542600      0.5888000    


%chk=000149336-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000149336

0 1
O -2.057502 -1.382756 0.727922
O 1.562026 2.071046 0.495457
O 3.843226 -2.098198 -0.573804
O 3.925763 0.678924 -0.092140
O -1.069227 -3.478141 0.464121
O -2.185327 2.688043 -0.444209
O -2.900846 1.585488 1.429846
O 0.602026 2.153083 2.646631
O 4.926181 -1.812120 1.493991
O 3.245466 1.709289 -2.096514
N -4.509623 -0.130206 -0.285005
N -5.058777 0.332788 -2.451279
N -2.916791 1.788481 0.143593
C -4.404300 -0.904964 0.973516
C -3.371786 -2.035719 0.884051
C -5.261760 -0.509650 -1.396129
C -3.781103 1.011626 -0.684307
C -4.138735 1.270748 -2.018734
C -6.185694 -1.685748 -1.426163
C 0.304908 -1.451312 0.399565
C -0.953762 -2.231395 0.530705
C 1.490563 -2.142199 0.047069
C 0.319117 -0.050772 0.596377
C 1.516745 0.660494 0.415307
C 2.677948 -1.418283 -0.126356
C 2.704987 -0.012884 0.045661
C 0.931678 2.743054 1.608450
C 4.961192 -2.204438 0.318929
C 4.072830 1.611204 -1.181286
C 0.742884 4.193484 1.256854
C 6.104156 -2.865725 -0.411595
C 5.356903 2.377105 -0.988885
H -5.395043 -1.339983 1.191359
H -4.128366 -0.211779 1.781064
H -3.548452 -2.714434 0.029991
H -3.379798 -2.634613 1.813464
H -3.786469 2.082385 -2.649221
H -5.654616 -2.644502 -1.280004
H -6.669880 -1.708907 -2.413712
H -6.973913 -1.616290 -0.653307
H 1.474307 -3.225270 -0.101734
H -0.590146 0.469775 0.900760
H 6.175237 1.696560 -0.702529
H 5.610193 2.919515 -1.910977
H 5.229566 3.099900 -0.163097
H -0.186124 4.274381 0.660656
H 0.632785 4.792889 2.172460
H 1.574519 4.566022 0.639063
H 6.425290 -2.233018 -1.257387
H 6.945855 -3.021199 0.277930
H 5.777589 -3.831478 -0.833317


