%chk=000098013.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000098013

0 1
 O    2.108600       3.638600     -0.1247000    
 C    1.238100       1.415000      0.1487000    
 C   -1.140500       1.097700      0.1557000    
 C   0.1357000      0.5654000      0.2426000    
 C    1.049000       2.785400     -3.0800000E-02
 C   -1.344500       2.456300     -2.2500001E-02
 C    2.576800      0.8478000      0.2406000    
 C  -0.2422000       3.305900     -0.1166000    
 C   -2.306200      0.2018000      0.2552000    
 C    4.287600     -0.9538000     -0.1099000    
 C    2.929400     -0.3868000     -0.1850000    
 C   -4.700700     -0.3977000     -0.1009000    
 C   -3.554100      0.4937000     -0.1815000    
 C    5.371500     -0.1020000      2.7600000E-02
 C    4.454100      -2.327500     -0.1785000    
 C   -4.507500      -1.769900      5.8699999E-02
 C   -5.993700      0.1196000     -0.1832000    
 C    6.657200     -0.6384000      9.8399997E-02
 C    5.739800      -2.863900     -0.1075000    
 C   -5.606800      -2.624900      0.1356000    
 C   -7.093100     -0.7355000     -0.1061000    
 C    6.841300      -2.019200      3.0800000E-02
 C   -6.899500      -2.107700      5.3399999E-02
 H   0.2587000     -0.5034000      0.4012000    
 H   -2.329600       2.909000     -7.1099997E-02
 H    3.309100       1.502100      0.7046000    
 H  -0.4044000       4.372200     -0.2511000    
 H   -2.093800     -0.7505000      0.7334000    
 H    2.191400      -1.039000     -0.6464000    
 H   -3.763700       1.446200     -0.6604000    
 H    5.278300      0.9788000      6.0899999E-02
 H    3.605900      -2.998600     -0.2847000    
 H   -3.521200      -2.221900      0.1051000    
 H   -6.164400       1.186400     -0.3060000    
 H    7.515700      1.8999999E-02  0.2007000    
 H    5.883500      -3.939200     -0.1600000    
 H   -5.456900      -3.694000      0.2544000    
 H   -8.099800     -0.3330000     -0.1701000    
 H    7.842300      -2.436900      8.4700003E-02
 H   -7.755600      -2.773600      0.1122000    
 H    1.778100       4.545100     -0.2465000    


%chk=000098013-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000098013

0 1
O 2.201537 3.662861 -0.045678
C 1.268393 1.429886 -0.018294
C -1.213879 1.129643 -0.021872
C 0.107733 0.610988 -0.010286
C 1.057823 2.843181 -0.038305
C -1.370313 2.548368 -0.042164
C 2.642891 0.911460 -0.007258
C -0.246981 3.390599 -0.050148
C -2.346083 0.191244 -0.012227
C 4.389553 -0.931478 0.021343
C 3.013999 -0.408201 0.010117
C -4.811650 -0.432604 -0.014635
C -3.679512 0.508084 -0.024839
C 5.548916 -0.099177 0.015590
C 4.585058 -2.343692 0.038992
C -4.659288 -1.851181 0.019920
C -6.137301 0.092047 -0.040181
C 6.840757 -0.659544 0.026892
C 5.878707 -2.905572 0.050363
C -5.783214 -2.699727 0.027837
C -7.263419 -0.756955 -0.032394
C 7.016035 -2.065628 0.044379
C -7.093164 -2.160080 0.001678
H 0.233537 -0.478175 0.005432
H -2.369571 2.994738 -0.051239
H 3.417191 1.686695 -0.014449
H -0.380477 4.480571 -0.065504
H -2.059870 -0.870255 0.006519
H 2.232617 -1.182243 0.016853
H -3.968781 1.568929 -0.045510
H 5.439174 0.990663 0.002334
H 3.706857 -3.002021 0.043769
H -3.657274 -2.293683 0.041403
H -6.277783 1.180218 -0.066602
H 7.717365 -0.001553 0.022194
H 6.000459 -3.994539 0.063830
H -5.642634 -3.786440 0.054698
H -8.271073 -0.326749 -0.052683
H 8.023218 -2.496701 0.053041
H -7.964499 -2.824153 0.007969
H 1.948846 4.618774 -0.059887


