%chk=000102218.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102218

0 1
 O   0.1613000       2.102000      0.2277000    
 O   -4.269900       1.670900       1.923800    
 O   -5.996900       1.329500     -0.9822000    
 C    5.969200     -0.1595000     -0.3874000    
 C    7.300600     -0.1874000      0.3684000    
 C    4.866900      0.6044000      0.3497000    
 C    8.422900     -0.8869000     -0.4016000    
 C    3.552600      0.5742000     -0.4348000    
 C    9.745200     -0.8216000      0.3664000    
 C    2.456400       1.363500      0.2871000    
 C    10.87700      -1.485900     -0.4173000    
 C    1.146800       1.375400     -0.4920000    
 C    12.19910      -1.393300      0.3276000    
 C   -1.143200       1.719400      4.9699999E-02
 C   -2.056500       1.889600       1.083500    
 C   -1.538500       1.167000      -1.163100    
 C   -3.788800      0.9470000     -0.3122000    
 C   -3.384200       1.501900      0.9020000    
 C   -2.865900      0.7795000      -1.344600    
 C   -5.168700      0.5313000     -0.5214000    
 C   -5.645700     -0.8464000     -0.1993000    
 C   -4.745700      -1.751500      0.3142000    
 C   -6.966600      -1.156500     -0.4280000    
 C   -5.191100      -3.038600      0.6154000    
 C   -7.412000      -2.443500     -0.1266000    
 C   -6.524200      -3.384500      0.3951000    
 H    5.640600      -1.190600     -0.5671000    
 H    6.125500      0.2987000      -1.372000    
 H    7.604200      0.8440000      0.5876000    
 H    7.156000     -0.6864000       1.334600    
 H    5.182900       1.643200      0.5035000    
 H    4.713900      0.1618000       1.341400    
 H    8.544400     -0.4104000      -1.381900    
 H    8.148300      -1.933200     -0.5815000    
 H    3.228300     -0.4643000     -0.5719000    
 H    3.710900      0.9994000      -1.433300    
 H    9.630900      -1.314800       1.339300    
 H    10.00340      0.2261000      0.5636000    
 H    2.783200       2.397300      0.4557000    
 H    2.281300      0.9392000       1.283700    
 H    10.98370      -1.006200      -1.397200    
 H    10.63650      -2.540300     -0.5964000    
 H   0.8471000      0.3299000     -0.6434000    
 H    1.299200       1.851300      -1.467800    
 H    12.99400      -1.875700     -0.2497000    
 H    12.48460     -0.3493000      0.4922000    
 H    12.13660      -1.890300       1.301000    
 H   -1.738400       2.321700       2.028500    
 H  -0.8593000       1.046700      -2.001400    
 H   -3.171000      0.3535000      -2.297100    
 H   -3.702600      -1.520100      0.4997000    
 H   -7.675700     -0.4414000     -0.8329000    
 H   -5.157900       1.384800       1.655700    
 H   -4.500300      -3.771700       1.021800    
 H   -8.450000      -2.713300     -0.2980000    
 H   -6.871200      -4.386600      0.6298000    


%chk=000102218-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000102218

0 1
O 0.223445 1.305858 0.878248
O -4.213386 2.792110 1.735935
O -6.173740 1.559442 0.761964
C 6.247782 -0.389669 -0.201574
C 7.668117 0.102099 0.156997
C 5.126751 0.492313 0.392400
C 8.788252 -0.784817 -0.432270
C 3.708454 0.000866 0.025082
C 10.210153 -0.293229 -0.079607
C 2.593952 0.886240 0.629114
C 11.328859 -1.184852 -0.665721
C 1.199502 0.388780 0.246698
C 12.746402 -0.685817 -0.311398
C -1.135748 1.066740 0.688043
C -2.005050 1.989381 1.304197
C -1.652520 -0.015516 -0.091753
C -3.955625 0.718845 0.432739
C -3.400043 1.845149 1.165147
C -3.038745 -0.169817 -0.204556
C -5.412652 0.586940 0.345972
C -6.093229 -0.632941 -0.193764
C -5.639916 -1.951191 0.083875
C -7.293579 -0.454610 -0.932869
C -6.363998 -3.066686 -0.390882
C -8.003813 -1.569219 -1.422090
C -7.539302 -2.879650 -1.154634
H 6.121154 -1.433329 0.155553
H 6.141071 -0.424294 -1.306193
H 7.797760 1.143799 -0.204329
H 7.774949 0.141308 1.261335
H 5.255223 1.536586 0.039362
H 5.229483 0.522425 1.497025
H 8.679328 -0.827061 -1.536474
H 8.660291 -1.825932 -0.068057
H 3.584244 -1.045624 0.374557
H 3.607707 -0.024148 -1.080331
H 10.320592 -0.247739 1.024276
H 10.341919 0.746128 -0.447269
H 2.709608 1.930531 0.281408
H 2.679032 0.902852 1.732434
H 11.216796 -1.231625 -1.768405
H 11.197702 -2.222602 -0.296293
H 1.026814 -0.642537 0.617415
H 1.059350 0.403648 -0.853748
H 13.526830 -1.340518 -0.741213
H 12.914027 0.337758 -0.696891
H 12.894273 -0.658370 0.784822
H -1.602788 2.831137 1.872083
H -0.985534 -0.710328 -0.607517
H -3.432054 -0.978663 -0.827238
H -4.753017 -2.104747 0.707307
H -7.654836 0.564164 -1.105853
H -5.187442 2.549606 1.460246
H -6.017241 -4.079137 -0.156663
H -8.920573 -1.420172 -2.002761
H -8.095794 -3.746864 -1.527277


