%chk=000072524.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072524

0 1
 O   -3.002900     -0.2913000      -1.654600    
 O   -2.758500       1.095000       1.740300    
 O   -2.243900      -2.609200     -0.4564000    
 O   -1.245100       2.003200      -1.440400    
 O    1.787000       2.604200     -0.3071000    
 O    3.267200      -2.567900      0.2713000    
 O   -2.638800       3.398100       1.873700    
 O   -4.298300      -3.083700      0.4876000    
 O   -2.409400       3.915000     -0.8693000    
 O    5.747500      -1.936000      0.1288000    
 N   0.4382000      -1.731900      0.2460000    
 N   0.4323000      -4.213100      0.6495000    
 C   -3.059200     -0.3173000     -0.2221000    
 C   -2.661400       1.090700      0.3158000    
 C   -2.082900      -1.411000      0.2946000    
 C   -1.224800       1.516100     -9.9399999E-02
 C  -0.2651000      0.3741000      1.2500000E-02
 C  -0.6746000     -0.9385000      0.1671000    
 C    1.154500      0.3609000     -2.4000000E-02
 C   -4.499000     -0.6775000      0.1652000    
 C    1.558800     -0.9517000      0.1216000    
 C    2.115800       1.432300     -0.1769000    
 C    2.925800      -1.398800      0.1401000    
 C    3.554200       1.029400     -0.1672000    
 C    3.943000     -0.3179000     -1.6500000E-02
 C   0.4350000      -3.067400      0.4633000    
 C   -2.469200       2.282800       2.347500    
 C   -3.493800      -3.159900     -0.4310000    
 C   -2.087200       3.052100      -1.674800    
 C    4.532200       2.020100     -0.3124000    
 C    5.301000     -0.6557000     -1.2600000E-02
 C   -1.900800       2.027500       3.710600    
 C   -3.752400      -3.888400      -1.714900    
 C   -2.575300       3.001700      -3.090800    
 C    5.883900       1.673100     -0.3072000    
 C    6.266600      0.3409000     -0.1580000    
 H   -3.411000       1.794800     -6.2100001E-02
 H   -2.263000      -1.622500       1.358000    
 H  -0.8263000       2.319000      0.5299000    
 H   -5.094600      0.2477000      0.1232000    
 H   -5.031800      -1.291100     -0.5668000    
 H   -4.604300     -0.9997000       1.205700    
 H   -3.159200      -1.187600      -1.990300    
 H    4.263500       3.066500     -0.4305000    
 H  -0.9790000       1.446700       3.623500    
 H   -2.633600       1.497900       4.324500    
 H   -1.667200       2.981900       4.190800    
 H   -2.926800      -4.572700      -1.927500    
 H   -3.882000      -3.178900      -2.534400    
 H   -4.665700      -4.482000      -1.613600    
 H   -3.192800       2.112900      -3.239400    
 H   -1.724800       2.999200      -3.777300    
 H   -3.181500       3.888600      -3.296400    
 H    6.640800       2.444200     -0.4200000    
 H    7.323300      8.6199999E-02 -0.1560000    
 H    5.006300      -2.552200      0.2231000    


%chk=000072524-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000072524

0 1
O -3.078092 -0.105352 -1.637531
O -2.749652 1.217536 1.795803
O -2.489107 -2.556728 -0.449127
O -1.168273 2.239991 -1.391476
O 1.772200 2.640540 -0.503620
O 3.167152 -2.743572 -0.291092
O -4.618828 2.626214 1.731661
O -3.398914 -3.532122 1.475812
O -1.451969 4.292024 -0.311176
O 5.627239 -2.145023 -0.655323
N 0.337971 -1.788334 0.013820
N 0.180084 -4.327710 0.264280
C -3.166762 -0.195511 -0.171552
C -2.692262 1.202087 0.307549
C -2.196470 -1.315246 0.329777
C -1.233287 1.581205 -0.057819
C -0.321963 0.395110 -0.099267
C -0.779596 -0.911070 0.070911
C 1.104059 0.338997 -0.269771
C -4.612754 -0.489650 0.262507
C 1.497032 -1.008415 -0.207029
C 2.099242 1.411451 -0.469515
C 2.859628 -1.483087 -0.347932
C 3.525377 0.955153 -0.619301
C 3.871122 -0.437112 -0.558699
C 0.286737 -3.144350 0.142216
C -3.749287 2.027249 2.392559
C -3.072344 -3.638547 0.279104
C -1.231174 3.648777 -1.359278
C 4.531433 1.917734 -0.819569
C 5.243585 -0.829189 -0.705209
C -3.569224 2.041066 3.891329
C -3.164352 -4.859558 -0.595787
C -0.977062 4.210130 -2.736239
C 5.886778 1.515063 -0.962837
C 6.246788 0.159670 -0.907847
H -3.385115 1.964738 -0.090415
H -2.386272 -1.531435 1.399582
H -0.895517 2.327249 0.687367
H -5.272849 0.320289 -0.087934
H -4.961067 -1.438248 -0.182989
H -4.704769 -0.577765 1.358282
H -3.177188 -1.024265 -2.000432
H 4.243784 2.972422 -0.859269
H -2.695699 2.666436 4.149815
H -3.373120 1.025279 4.271919
H -4.464587 2.463695 4.369250
H -2.172287 -5.348880 -0.610350
H -3.423561 -4.591814 -1.632214
H -3.900004 -5.563336 -0.179988
H -1.428396 3.569025 -3.509618
H 0.114160 4.235996 -2.910665
H -1.370979 5.234987 -2.801454
H 6.662817 2.271584 -1.117816
H 7.284207 -0.168997 -1.015699
H 4.782086 -2.717479 -0.503404


