%chk=000080354.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080354

0 1
 O    5.247100     -0.4647000     -1.7500000E-02
 O    6.647600       1.368700      1.6500000E-02
 C   -2.249000     -0.4582000      1.6799999E-02
 C   -3.540800      0.3662000      1.0900000E-02
 C  -0.9822000      0.4005000      3.1800002E-02
 C   -4.846700     -0.4331000      8.5600004E-02
 C   0.3089000     -0.4243000      2.5000000E-02
 C   -6.100700      0.4421000      1.5799999E-02
 C    1.576700      0.4337000      1.5400000E-02
 C   -7.403700     -0.3641000      1.7000000E-03
 C    2.835300     -0.4396000     -1.9500000E-02
 C   -8.658000      0.5054000     -9.4800003E-02
 C    4.113200      0.3905000     -3.4000000E-03
 C   -9.922700     -0.3377000     -2.8600000E-02
 C    6.468000      0.1588000     -5.2000000E-03
 C    7.561100     -0.8839000     -2.1900000E-02
 C    8.945800     -0.2603000     -2.8400000E-02
 H   -2.248000      -1.113800      0.8962000    
 H   -2.237600      -1.110700     -0.8647000    
 H   -3.555100      0.9816000     -0.8978000    
 H   -3.515600       1.065700      0.8562000    
 H  -0.9885000       1.064500     -0.8415000    
 H  -0.9923000       1.044600      0.9197000    
 H   -4.865600      -1.154800     -0.7403000    
 H   -4.860800      -1.015200       1.015000    
 H   0.3094000      -1.078100     -0.8561000    
 H   0.3207000      -1.078900      0.9052000    
 H   -6.057000       1.061300     -0.8887000    
 H   -6.108700       1.129800      0.8703000    
 H    1.565900       1.096800     -0.8578000    
 H    1.593700       1.071100      0.9075000    
 H   -7.452800     -0.9718000      0.9140000    
 H   -7.385200      -1.063800     -0.8431000    
 H    2.829400      -1.076500     -0.9128000    
 H    2.841900      -1.125900      0.8367000    
 H   -8.645800       1.071500      -1.033100    
 H   -8.668600       1.233600      0.7244000    
 H    4.139700       1.011200      0.9002000    
 H    4.140400       1.044200     -0.8834000    
 H   -9.978500     -0.8884000      0.9157000    
 H   -10.80800      0.3016000     -0.1018000    
 H   -9.956000      -1.059800     -0.8507000    
 H    7.450900      -1.515000      0.8662000    
 H    7.437500      -1.500700     -0.9182000    
 H    9.086600      0.3755000     -0.9088000    
 H    9.102100      0.3597000      0.8605000    
 H    9.714500      -1.039000     -4.2100001E-02


%chk=000080354-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000080354

0 1
O 5.304071 -0.475278 0.013816
O 6.734503 1.365217 -0.036711
C -2.282658 -0.393879 0.001338
C -3.574235 0.454513 -0.007669
C -0.991541 0.455127 -0.008987
C -4.864316 -0.396214 -0.000476
C 0.298044 -0.395736 0.001394
C -6.157514 0.449984 -0.007507
C 1.588471 0.454228 -0.009146
C -7.447108 -0.401396 0.002881
C 2.872454 -0.408067 0.006903
C -8.740556 0.445293 -0.004384
C 4.134214 0.454454 -0.009489
C -10.023629 -0.413568 0.004746
C 6.569127 0.124085 -0.002485
C 7.657471 -0.938398 0.029364
C 9.075189 -0.342273 -0.010439
H -2.282283 -1.050167 0.896802
H -2.283284 -1.070442 -0.878924
H -3.574239 1.112454 -0.901886
H -3.575782 1.129301 0.873874
H -0.991595 1.110716 -0.904917
H -0.991565 1.132157 0.870844
H -4.863333 -1.070160 -0.882770
H -4.863248 -1.055482 0.892879
H 0.297977 -1.072562 -0.878293
H 0.298143 -1.050850 0.897392
H -6.160099 1.107422 -0.902232
H -6.157833 1.125802 0.873437
H 1.588720 1.106229 -0.907441
H 1.585257 1.133389 0.868751
H -7.446169 -1.058919 0.897562
H -7.448520 -1.077323 -0.877983
H 2.882595 -1.084043 -0.869694
H 2.882723 -1.050382 0.908463
H -8.739568 1.102734 -0.897884
H -8.738455 1.119721 0.876349
H 4.198161 1.120904 0.870986
H 4.202087 1.081426 -0.918170
H -10.063502 -1.055731 0.904952
H -10.933558 0.214354 -0.003272
H -10.062066 -1.076506 -0.880349
H 7.504598 -1.550786 0.938979
H 7.485056 -1.625348 -0.821349
H 9.228939 0.252107 -0.927208
H 9.246370 0.329040 0.848230
H 9.830984 -1.146848 0.016819


