%chk=000038762.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038762

0 1
 O   -7.782600     -0.4730000     -4.3299999E-02
 O   -6.673800       1.551500     -8.9699998E-02
 C    2.234200     -0.4927000      0.1001000    
 C    3.489600      0.3812000      6.8599999E-02
 C   0.9652000      0.3620000      0.1282000    
 C    4.791600     -0.4236000      7.4000000E-03
 C  -0.2927000     -0.5098000      0.1267000    
 C    6.085200      0.3967000      5.8800001E-02
 C   -1.559900      0.3470000      0.1208000    
 C    7.349100     -0.4580000     -6.1900001E-02
 C   -2.851800     -0.4751000      8.7200001E-02
 C    8.642200      0.3612000     -2.9000000E-03
 C   -4.156800      0.3293000      5.7500001E-02
 C    9.903200     -0.4817000     -0.1980000    
 C   -5.431100     -0.5101000      8.1600003E-02
 C    11.15890      0.3732000     -0.1192000    
 C   -6.679800      0.3289000     -2.6699999E-02
 C   -9.037100      0.2077000     -0.1446000    
 C   -10.15370     -0.8145000     -0.1505000    
 H    2.261400      -1.144000      0.9818000    
 H    2.221200      -1.143200     -0.7829000    
 H    3.447500       1.052500     -0.7980000    
 H    3.507000       1.018300      0.9615000    
 H   0.9515000       1.026000     -0.7447000    
 H   0.9702000       1.000100       1.020300    
 H    4.801900      -1.139600      0.8392000    
 H    4.788400      -1.020800     -0.9134000    
 H  -0.2932000      -1.160700       1.009200    
 H  -0.2885000      -1.160700     -0.7560000    
 H    6.071300       1.135700     -0.7516000    
 H    6.115100      0.9590000       1.000000    
 H   -1.569000      0.9892000       1.010000    
 H   -1.543200       1.013600     -0.7503000    
 H    7.360100      -1.205000      0.7413000    
 H    7.317400      -1.011300      -1.008700    
 H   -2.829100      -1.132500     -0.7912000    
 H   -2.868700      -1.133900      0.9648000    
 H    8.694300      0.8771000      0.9639000    
 H    8.608200       1.139900     -0.7752000    
 H   -4.155000      0.9611000     -0.8402000    
 H   -4.166300       1.017900      0.9124000    
 H    9.949000      -1.263200      0.5692000    
 H    9.867300     -0.9836000      -1.171800    
 H   -5.478700      -1.078900       1.016700    
 H   -5.419900      -1.211700     -0.7600000    
 H    11.15660       1.146200     -0.8943000    
 H    12.04910     -0.2476000     -0.2612000    
 H    11.23900      0.8640000      0.8560000    
 H   -9.063100      0.7896000      -1.072700    
 H   -9.157100      0.8819000      0.7109000    
 H   -10.03740      -1.507400     -0.9904000    
 H   -10.12980      -1.416600      0.7638000    
 H   -11.12960     -0.3272000     -0.2271000    


%chk=000038762-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000038762

0 1
O -7.866357 -0.475080 -0.046350
O -6.831825 1.582543 0.308927
C 2.256963 -0.478273 0.007100
C 3.548869 0.369708 0.002407
C 0.966324 0.371575 0.017489
C 4.840001 -0.479489 -0.007954
C -0.325631 -0.476249 0.024030
C 6.131474 0.369254 -0.011486
C -1.615570 0.374437 0.034277
C 7.423276 -0.479134 -0.021910
C -2.907185 -0.473773 0.042942
C 8.714426 0.370167 -0.023901
C -4.190869 0.384673 0.055837
C 10.006659 -0.478416 -0.034932
C -5.468430 -0.476680 0.060631
C 11.290923 0.378944 -0.036056
C -6.745126 0.346593 0.123831
C -9.196472 0.206054 0.018651
C -10.254030 -0.875285 -0.179084
H 2.261754 -1.147795 0.892838
H 2.251431 -1.142000 -0.882989
H 3.544109 1.039424 -0.883138
H 3.554324 1.033319 0.892532
H 0.961111 1.040326 -0.868728
H 0.972587 1.036098 0.906869
H 4.844674 -1.149616 0.877319
H 4.835157 -1.142620 -0.898480
H -0.320105 -1.144617 0.910662
H -0.331609 -1.140984 -0.865336
H 6.126678 1.039617 -0.896557
H 6.136168 1.032304 0.879080
H -1.609031 1.039897 0.922635
H -1.621555 1.041891 -0.852639
H 7.427812 -1.150178 0.862721
H 7.419326 -1.141442 -0.913108
H -2.912558 -1.139007 -0.846189
H -2.898765 -1.141178 0.930531
H 8.720052 1.032189 0.867485
H 8.711216 1.041620 -0.908218
H -4.202037 1.055043 -0.825393
H -4.193007 1.047267 0.942139
H 10.008564 -1.149392 0.848454
H 10.000137 -1.139083 -0.926043
H -5.468684 -1.165827 0.929347
H -5.517997 -1.127050 -0.833672
H 11.326175 1.037318 -0.924721
H 12.200173 -0.250147 -0.045007
H 11.335623 1.025573 0.860766
H -9.229039 0.981250 -0.768350
H -9.282585 0.709981 0.998573
H -10.131551 -1.371889 -1.156812
H -10.185259 -1.642269 0.611219
H -11.262908 -0.425195 -0.140835


