%chk=000101789.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101789

0 1
 O  -0.1725000       2.529500      0.4404000    
 O   -6.408300      0.2025000     -0.1441000    
 O    5.518000      0.1583000      0.8359000    
 C   8.1100002E-02  -1.039800      0.1926000    
 C    1.501800      -1.072600     -0.3872000    
 C  -0.6434000      0.2454000     -0.3202000    
 C    2.347800      0.1529000      2.6500000E-02
 C   -2.128300      0.3305000      0.1853000    
 C   -2.845000     -0.9898000     -0.2611000    
 C  -0.6997000      -2.307900     -0.1783000    
 C    3.686400     -0.2314000     -0.6404000    
 C    2.405400      -2.255200     -5.2099999E-02
 C    1.684800       1.405600     -0.5487000    
 C   -2.154600      -2.247600      0.2767000    
 C   0.2420000       1.487000     -6.2600002E-02
 C   -2.882700       1.509600     -0.4973000    
 C    3.818400      -1.746700     -0.3861000    
 C   -4.343900     -0.9979000      6.5800004E-02
 C   -2.178100      0.5156000       1.723400    
 C    2.508400      0.3197000       1.560600    
 C   -4.388100       1.517100     -0.2214000    
 C   -5.052300      0.1914000     -0.5778000    
 C    4.870800      0.5354000     -0.1398000    
 C    5.232000       1.788700     -0.8901000    
 H   0.1524000      -1.011700       1.284900    
 H    1.396700      -1.068400      -1.485300    
 H  -0.6906000      0.1807000      -1.419000    
 H   -2.773100      -1.044400      -1.359000    
 H  -0.2263000      -3.188200      0.2719000    
 H  -0.6704000      -2.456400      -1.265500    
 H    3.624900     -8.5000001E-02  -1.727800    
 H    2.154600      -3.144500     -0.6392000    
 H    2.335400      -2.526900       1.007000    
 H    1.668800       1.395400      -1.644600    
 H    2.211100       2.312600     -0.2335000    
 H   -2.673300      -3.142100     -8.9599997E-02
 H   -2.208500      -2.286200       1.370500    
 H   -2.729400       1.459300      -1.583500    
 H   -2.482000       2.475600     -0.1747000    
 H    4.506400      -2.006200      0.4252000    
 H    4.196900      -2.241300      -1.288500    
 H   -4.805400      -1.923400     -0.3029000    
 H   -4.517400      -1.007300       1.148600    
 H   -3.200700      0.5056000       2.110800    
 H   -1.636400     -0.2674000       2.259600    
 H   -1.743800       1.472500       2.027800    
 H    1.549600      0.4648000       2.067500    
 H    2.992900     -0.5428000       2.028500    
 H    3.114300       1.202500       1.795200    
 H   -4.584900       1.764200      0.8289000    
 H   -4.860300       2.324800     -0.7949000    
 H   -5.054200      6.2799998E-02  -1.667000    
 H    5.391500       1.555300      -1.945800    
 H    4.443000       2.534300     -0.7828000    
 H    6.160100       2.201000     -0.4838000    
 H   -6.845800      0.9595000     -0.5696000    


%chk=000101789-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000101789

0 1
O -0.165810 2.496792 0.619449
O -6.488023 0.201389 -0.261087
O 5.655226 0.228160 0.775900
C 0.080217 -1.078640 0.233271
C 1.510330 -1.106918 -0.345935
C -0.660277 0.227111 -0.255295
C 2.365721 0.145965 0.031602
C -2.149426 0.319558 0.235074
C -2.872843 -0.987357 -0.265882
C -0.719734 -2.338511 -0.179848
C 3.734951 -0.255061 -0.657864
C 2.433332 -2.301969 -0.007021
C 1.655649 1.398935 -0.549341
C -2.198083 -2.273756 0.257503
C 0.220550 1.469638 -0.001902
C -2.859065 1.531197 -0.454367
C 3.870724 -1.783024 -0.349602
C -4.394045 -0.967623 0.015941
C -2.216686 0.474089 1.780031
C 2.549292 0.318802 1.561887
C -4.387308 1.561719 -0.204556
C -5.061512 0.247086 -0.641664
C 4.939396 0.575248 -0.203386
C 5.239408 1.846227 -0.989166
H 0.139921 -1.060478 1.340292
H 1.402379 -1.083544 -1.456341
H -0.692868 0.133914 -1.369356
H -2.750367 -0.993502 -1.375958
H -0.231886 -3.235543 0.247892
H -0.672440 -2.444669 -1.285403
H 3.599400 -0.092102 -1.747169
H 2.171658 -3.206899 -0.582408
H 2.352290 -2.564217 1.064903
H 1.618717 1.321854 -1.656400
H 2.162364 2.341329 -0.275667
H -2.741640 -3.158534 -0.129135
H -2.271636 -2.319516 1.362227
H -2.674917 1.472294 -1.549592
H -2.409278 2.474458 -0.101997
H 4.567946 -1.922358 0.494417
H 4.298211 -2.312762 -1.219412
H -4.860148 -1.892888 -0.373867
H -4.601398 -0.940521 1.102746
H -3.258679 0.457878 2.141376
H -1.680061 -0.335114 2.306018
H -1.765202 1.434253 2.080053
H 1.578847 0.435823 2.075337
H 3.082694 -0.534744 2.012284
H 3.142194 1.224205 1.782796
H -4.602919 1.728474 0.868338
H -4.830161 2.416961 -0.756512
H -4.969659 0.153009 -1.749564
H 5.638670 1.576209 -1.986957
H 4.320739 2.435693 -1.162835
H 5.987332 2.458206 -0.461391
H -6.935985 1.012773 -0.613055


