%chk=000099953.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099953

0 1
 O    6.822800     -0.1449000      0.3643000    
 O    3.294000      5.2299999E-02 -0.3223000    
 C    5.668400      8.4399998E-02 -0.4538000    
 C    6.217100       1.151700      0.4479000    
 C   -1.633800      0.3434000     -0.1570000    
 C   -2.931800     -0.3854000      0.1966000    
 C  -0.4116000     -0.5358000      0.1201000    
 C    4.467400     -0.7089000     -6.8300001E-02
 C   0.8866000      0.1819000     -0.2610000    
 C   -4.191200      0.4378000     -9.0800002E-02
 C    2.119900     -0.6645000      3.0500000E-02
 C   -5.524100     -0.2488000      0.2225000    
 C   -6.744800      0.5986000     -0.1369000    
 C   -8.039200     -0.1617000      0.1082000    
 H    5.805100      0.1833000      -1.521700    
 H    5.679300       1.396000       1.354700    
 H    6.746300       1.979800     -5.2999998E-03
 H   -1.563100       1.270200      0.4246000    
 H   -1.650800      0.6261000      -1.216500    
 H   -2.986200      -1.323900     -0.3690000    
 H   -2.918700     -0.6571000       1.259300    
 H  -0.3853000     -0.8034000       1.183300    
 H  -0.4918000      -1.470500     -0.4479000    
 H    4.503700     -0.9781000      0.9944000    
 H    4.442800      -1.632400     -0.6581000    
 H   0.9658000       1.131600      0.2827000    
 H   0.8737000      0.4472000      -1.325500    
 H   -4.137100       1.374200      0.4788000    
 H   -4.185800      0.7214000      -1.151100    
 H    2.073800      -1.596400     -0.5455000    
 H    2.153000     -0.9146000       1.097600    
 H   -5.555700     -0.5008000       1.289700    
 H   -5.568000      -1.197300     -0.3272000    
 H   -6.696200      0.8917000      -1.192100    
 H   -6.744300       1.519900      0.4567000    
 H   -8.082500      -1.070300     -0.5009000    
 H   -8.132100     -0.4481000       1.160600    
 H   -8.899900      0.4624000     -0.1515000    


%chk=000099953-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000099953

0 1
O 7.067711 -0.259427 -0.061739
O 3.318571 0.101008 -0.228354
C 5.695624 0.172015 -0.531694
C 6.495989 1.081552 0.344758
C -1.680160 0.335415 -0.141790
C -3.008974 -0.392469 0.161708
C -0.432655 -0.523116 0.165480
C 4.553462 -0.650265 0.024311
C 0.893067 0.202710 -0.159906
C -4.259616 0.460817 -0.147891
C 2.118410 -0.662117 0.146116
C -5.588062 -0.274403 0.140195
C -6.840292 0.576999 -0.170519
C -8.162214 -0.170108 0.110351
H 5.637513 0.394036 -1.604726
H 6.231507 1.165053 1.406427
H 7.001199 1.949900 -0.094382
H -1.633124 1.275371 0.446571
H -1.663071 0.636228 -1.210125
H -3.053068 -1.332903 -0.426872
H -3.026599 -0.694093 1.230144
H -0.445419 -0.814084 1.236923
H -0.489802 -1.467881 -0.414950
H 4.700349 -0.823888 1.112754
H 4.514050 -1.641065 -0.481247
H 0.964264 1.142901 0.420272
H 0.917123 0.484254 -1.230485
H -4.222278 1.396948 0.447893
H -4.237097 0.770568 -1.213921
H 2.083545 -1.613595 -0.432781
H 2.157738 -0.921991 1.228738
H -5.612948 -0.584951 1.205991
H -5.625986 -1.210203 -0.456217
H -6.811330 0.892469 -1.233657
H -6.805726 1.508762 0.430496
H -8.235450 -1.088426 -0.502542
H -8.229022 -0.471001 1.173094
H -9.041526 0.459980 -0.118324


