%chk=000153791.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153791

0 1
 O    1.212400      -1.620000       1.002700    
 O   0.4554000      0.3959000       1.826400    
 O  -9.9399999E-02   3.121300      0.5393000    
 O  -0.9090000       3.447100      -1.475000    
 N  -7.9599999E-02  0.6016000      -1.069000    
 N   -3.726200      -1.087100      0.1203000    
 N  -0.9997000       2.977600     -0.3183000    
 C    1.159200      0.1938000     -0.4967000    
 C   -1.327000      5.8699999E-02 -0.6577000    
 C    2.147800       1.365700     -0.4770000    
 C   -2.338000      0.8631000     -0.1221000    
 C   -1.516900      -1.319200     -0.8039000    
 C   -3.538200      0.2396000      0.2590000    
 C   -2.749200      -1.857400     -0.3962000    
 C    3.583800      0.9202000     -0.3404000    
 C   -2.174400       2.250300      3.6300000E-02
 C   0.8906000     -0.2945000      0.9139000    
 C  -0.5182000      -2.151500      -1.339000    
 C   -4.548400       1.035000      0.7931000    
 C   -2.944200      -3.228500     -0.5394000    
 C   -3.199900       3.023100      0.5728000    
 C    4.151100      0.7741000      0.9255000    
 C    4.343100      0.6538000      -1.479900    
 C   -4.389200       2.413900      0.9517000    
 C  -0.7382000      -3.519200      -1.471500    
 C   -1.953900      -4.058500      -1.070600    
 C    5.477700      0.3619000       1.052100    
 C    5.669600      0.2415000      -1.353300    
 C    1.010800      -2.219700       2.286300    
 C    6.236900      9.5500000E-02 -8.7200001E-02
 C    1.411200      -3.678000       2.217700    
 H    1.639900     -0.5922000      -1.082200    
 H    1.950500       2.053000      0.3502000    
 H    2.056100       1.965800      -1.392500    
 H  -9.3999997E-02   1.230400      -1.864400    
 H   0.3946000      -1.798200      -1.792000    
 H   -5.489800      0.5812000       1.097800    
 H   -3.888800      -3.674900     -0.2338000    
 H   -3.091900       4.097300      0.7029000    
 H    3.571900      0.9784000       1.822000    
 H    3.911400      0.7616000      -2.471400    
 H   -5.196000       3.007600       1.371500    
 H   2.3100000E-02  -4.156500      -1.911000    
 H   -2.138300      -5.123600      -1.175600    
 H    5.919400      0.2480000       2.037700    
 H    6.260700      3.3300001E-02  -2.240300    
 H    1.624800      -1.701500       3.031300    
 H  -4.5899998E-02  -2.138500       2.564500    
 H    7.269600     -0.2258000      1.1300000E-02
 H   0.8150000      -4.206400       1.466600    
 H    2.459700      -3.775900       1.917500    
 H    1.273200      -4.167500       3.185800    


%chk=000153791-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000153791

0 1
O 1.777284 -1.859599 0.690207
O 0.473126 -0.279896 1.805913
O -1.097497 4.516082 -0.078335
O -0.795867 3.102546 -1.837914
N -0.179511 0.667956 -0.927836
N -4.041778 -0.822832 0.196177
N -1.385169 3.430191 -0.713083
C 1.119113 0.076738 -0.563972
C -1.460015 0.205781 -0.665095
C 2.140518 1.258941 -0.408522
C -2.530444 1.124418 -0.309752
C -1.769485 -1.208028 -0.719598
C -3.791274 0.521261 0.143059
C -3.063459 -1.670295 -0.247645
C 3.555001 0.787019 -0.114345
C -2.477328 2.573251 -0.200623
C 1.048115 -0.684495 0.771246
C -0.877350 -2.183005 -1.281904
C -4.865710 1.343207 0.634330
C -3.365000 -3.076480 -0.259853
C -3.528690 3.337887 0.331138
C 4.063016 0.805087 1.209400
C 4.384274 0.297349 -1.155706
C -4.739975 2.723026 0.742927
C -1.210437 -3.537213 -1.316605
C -2.456929 -3.995134 -0.777394
C 5.367981 0.339527 1.488074
C 5.688138 -0.170674 -0.881426
C 1.887822 -2.661574 1.950971
C 6.184028 -0.152754 0.443389
C 2.890859 -3.775844 1.675853
H 1.518782 -0.612778 -1.330231
H 1.768315 1.921817 0.393641
H 2.116444 1.832369 -1.356067
H -0.126880 1.619030 -1.322756
H 0.062545 -1.865347 -1.735368
H -5.774018 0.812436 0.933456
H -4.340777 -3.376965 0.133243
H -3.402910 4.421994 0.391094
H 3.434845 1.190743 2.022001
H 4.010003 0.290668 -2.187544
H -5.558746 3.337804 1.127656
H -0.517417 -4.254195 -1.769539
H -2.699137 -5.063351 -0.795440
H 5.749402 0.368000 2.515092
H 6.318864 -0.541051 -1.697473
H 2.211509 -1.985478 2.762404
H 0.879610 -3.042458 2.194930
H 7.197982 -0.509237 0.656909
H 2.549182 -4.420144 0.847703
H 3.876685 -3.357364 1.410735
H 3.007559 -4.403241 2.578282


