%chk=000132465.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132465

0 1
 O    1.805700     -0.2434000      -2.335700    
 O    4.946100       1.644900      0.6438000    
 O    4.973100       3.441500     -0.7286000    
 O  -0.8781000     -0.7747000      0.5516000    
 O   -3.381100     -8.5000005E-03  -1.932300    
 O   -8.557000      0.7952000       1.617400    
 N    2.725900      0.6231000     -0.3867000    
 N   0.4878000      -2.089700     -0.7937000    
 N    5.315700      -2.208800     -9.7000003E-03
 N    5.434300      -1.951200       2.193000    
 N   -3.129600      -1.807000     -0.4880000    
 C    1.969200       2.933800     -0.8310000    
 C    1.218800       3.070700      0.5134000    
 C    3.110000       1.908200     -0.9106000    
 C    1.758300      -1.595700     -0.3245000    
 C    2.867800      -2.646100     -0.4557000    
 C    2.099300     -0.3579000      -1.147500    
 C   6.3100003E-02   4.067900      0.4766000    
 C    2.212400       3.482200       1.606400    
 C    4.414600       2.426500     -0.3264000    
 C    4.039400      -2.361400      0.4542000    
 C  -0.7342000      -1.635000     -0.3134000    
 C    4.138000      -2.198500       1.816000    
 C   -1.894700      -2.292800      -1.029100    
 C    6.117800      -1.964400       1.070200    
 C   -3.784800     -0.6859000     -0.9905000    
 C   -5.042100     -0.2955000     -0.3021000    
 C   -5.461600       1.034700     -0.3181000    
 C   -5.803500      -1.259100      0.3593000    
 C   -6.642400       1.401400      0.3276000    
 C   -6.984300     -0.8923000       1.005000    
 C   -7.403700      0.4379000      0.9891000    
 H    2.342200       3.920800      -1.135300    
 H    1.220400       2.654400      -1.585400    
 H   0.7944000       2.096200      0.7853000    
 H    3.338000       1.752700      -1.974200    
 H    1.620100      -1.305600      0.7243000    
 H    2.914300      0.4415000      0.5948000    
 H    2.476400      -3.635000     -0.1825000    
 H    3.208000      -2.722100      -1.496500    
 H  -0.4574000       4.103700       1.439400    
 H  -0.6666000       3.781600     -0.2880000    
 H   0.4187000       5.077000      0.2428000    
 H    2.889800       2.664700       1.862500    
 H    1.682000       3.737800       2.531000    
 H    2.800900       4.357200       1.311200    
 H   0.4924000      -2.753100      -1.563600    
 H    5.615200      -2.264400     -0.9741000    
 H    3.343200      -2.246500       2.546300    
 H   -1.856100      -3.374900     -0.8725000    
 H   -1.837200      -2.072500      -2.099700    
 H    5.797500       2.000500      0.9766000    
 H    7.181900      -1.804800      0.9705000    
 H   -3.477400      -2.274700      0.3422000    
 H   -4.880000       1.800700     -0.8242000    
 H   -5.528800      -2.309600      0.3697000    
 H   -6.958000       2.441100      0.3086000    
 H   -7.577300      -1.648200       1.512800    
 H   -8.693700       1.751600       1.505000    


%chk=000132465-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000132465

0 1
O 3.912430 0.009862 -1.105133
O 2.187927 1.396655 3.014338
O 2.841391 3.554562 2.457271
O -0.005091 -1.099878 1.010782
O -3.933282 -1.156115 -1.919154
O -7.460389 2.505943 2.091539
N 2.344204 0.449366 0.558109
N 1.046246 -1.862894 -0.915027
N 5.705144 -2.076192 -0.607860
N 6.611636 -3.910654 0.355659
N -2.430837 -0.969557 -0.174113
C 1.936049 2.787858 -0.332417
C 0.397082 2.606592 -0.406060
C 2.704077 1.867850 0.673112
C 2.417213 -1.837164 -0.342323
C 3.317627 -2.804349 -1.153984
C 2.966750 -0.375919 -0.335989
C -0.163090 3.517416 -1.525839
C -0.322595 2.889772 0.934851
C 2.591699 2.382979 2.106573
C 4.686442 -3.038937 -0.576960
C -0.071174 -1.535700 -0.190170
C 5.272775 -4.164594 0.017532
C -1.417583 -1.731195 -0.892307
C 6.836388 -2.636883 -0.035732
C -3.655009 -0.699458 -0.759930
C -4.619836 0.144493 0.021077
C -5.949253 0.228365 -0.464919
C -4.275035 0.873245 1.192899
C -6.917388 1.002195 0.200332
C -5.231744 1.653061 1.867166
C -6.556047 1.713765 1.371950
H 2.179452 3.836096 -0.071701
H 2.364482 2.588981 -1.333005
H 0.188502 1.553610 -0.690777
H 3.776770 1.951005 0.404256
H 2.339491 -2.179842 0.706447
H 1.576443 0.061014 1.131489
H 2.798850 -3.778896 -1.203485
H 3.403543 -2.412660 -2.187971
H -1.249981 3.362809 -1.654205
H 0.327282 3.314160 -2.496328
H -0.000070 4.584682 -1.281463
H -0.051295 2.158328 1.718216
H -1.419005 2.835401 0.798436
H -0.078117 3.902122 1.308041
H 0.949850 -2.120797 -1.900865
H 5.541620 -1.121776 -0.952547
H 4.819830 -5.134609 0.214546
H -1.663810 -2.814379 -0.914975
H -1.385896 -1.401712 -1.948403
H 2.147787 1.784487 3.930201
H 7.777291 -2.103776 0.075845
H -2.181644 -0.686310 0.777608
H -6.195974 -0.324075 -1.377204
H -3.251778 0.863434 1.586771
H -7.943150 1.053660 -0.186936
H -4.976586 2.221933 2.765633
H -8.357513 2.492819 1.674105


