%chk=000075667.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075667

0 1
 O    7.370000     -0.8130000      0.5133000    
 O    4.719900      0.1089000      -1.577200    
 N    4.804100      0.2769000     -0.2188000    
 C    3.540100      0.9405000      0.2505000    
 C    5.995800       1.141800      0.1336000    
 C    4.964000      -1.061900      0.4701000    
 C    2.311000      0.1051000     -7.5099997E-02
 C   0.9681000      0.7473000      0.2910000    
 C    7.298200      0.4274000     -0.1922000    
 C    6.307500      -1.688200      0.1306000    
 C  -0.2816000     -5.9599999E-02 -7.3299997E-02
 C   -1.586100      0.5960000      0.3869000    
 C   -2.802600     -0.2064000     -8.2800001E-02
 C   -4.139100      0.4190000      0.3270000    
 C   -5.354400     -0.3959000     -0.1214000    
 C   -6.661400      0.3095000      0.2482000    
 C   -7.877000     -0.4842000     -0.2335000    
 C   -9.183100      0.2028000      0.1647000    
 C   -10.39320     -0.5658000     -0.3417000    
 H    3.497900       1.910900     -0.2578000    
 H    3.636200       1.103400       1.329700    
 H    5.919200       1.339200       1.208800    
 H    5.892500       2.074300     -0.4307000    
 H    4.876700     -0.8694000       1.545000    
 H    4.167400      -1.724100      0.1238000    
 H    2.290400     -0.1397000      -1.143800    
 H    2.346500     -0.8503000      0.4585000    
 H   0.9048000       1.727700     -0.1981000    
 H   0.9608000      0.9409000       1.371300    
 H    8.147600       1.040300      0.1248000    
 H    7.405200      0.2406000      -1.266800    
 H    6.394400      -1.918800     -0.9374000    
 H    6.432000      -2.624400      0.6836000    
 H  -0.3052000     -0.1989000      -1.161300    
 H  -0.2050000      -1.059300      0.3717000    
 H   -1.645300       1.615200     -1.3100000E-02
 H   -1.593700      0.6756000       1.480400    
 H   -2.743000      -1.223200      0.3250000    
 H   -2.774600     -0.3015000      -1.175400    
 H   -4.202200       1.428700     -9.7700000E-02
 H   -4.163800      0.5326000       1.417900    
 H   -5.312500     -0.5448000      -1.207100    
 H   -5.322800      -1.388600      0.3432000    
 H   -6.679000       1.311400     -0.1978000    
 H   -6.712300      0.4386000       1.336100    
 H   -7.850000      -1.494600      0.1925000    
 H   -7.834900     -0.5924000      -1.324200    
 H   -9.208400       1.220100     -0.2430000    
 H   -9.241000      0.2888000       1.256000    
 H   -10.41520      -1.579300      7.1400002E-02
 H   -10.38240     -0.6398000      -1.433800    
 H   -11.31620     -5.7799999E-02 -4.4900000E-02


%chk=000075667-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000075667

0 1
O 7.633010 -0.631073 0.144812
O 4.685986 0.182164 -1.524450
N 4.840394 0.228390 -0.107404
C 3.539745 0.723533 0.560070
C 5.979594 1.205440 0.259337
C 5.231317 -1.167855 0.429899
C 2.322655 -0.118141 0.159007
C 0.998927 0.629923 0.439695
C 7.283411 0.705725 -0.369023
C 6.561997 -1.581467 -0.205857
C -0.249154 -0.208337 0.083172
C -1.576282 0.542991 0.331848
C -2.828776 -0.290760 -0.020354
C -4.154214 0.465161 0.224345
C -5.409277 -0.365381 -0.126505
C -6.733245 0.393412 0.118214
C -7.990183 -0.435183 -0.230751
C -9.313128 0.326136 0.014255
C -10.564350 -0.509619 -0.332606
H 3.418684 1.755501 0.186012
H 3.694853 0.747094 1.657442
H 6.063152 1.266237 1.361225
H 5.687432 2.180556 -0.163590
H 5.307223 -1.123370 1.532719
H 4.425817 -1.852197 0.122642
H 2.425654 -0.328434 -0.922975
H 2.313608 -1.085827 0.699116
H 0.984830 1.571781 -0.146978
H 0.945142 0.924955 1.509343
H 8.123851 1.363359 -0.093722
H 7.156679 0.675815 -1.468887
H 6.426802 -1.622374 -1.304727
H 6.889751 -2.560061 0.180787
H -0.191608 -0.511414 -0.982592
H -0.243412 -1.147596 0.675098
H -1.582398 1.480468 -0.262782
H -1.629645 0.850821 1.397480
H -2.825701 -1.227384 0.575893
H -2.775007 -0.600554 -1.085034
H -4.156678 1.401396 -0.372460
H -4.207183 0.776154 1.289006
H -5.357019 -0.676515 -1.190997
H -5.408000 -1.301546 0.470479
H -6.734408 1.329162 -0.479486
H -6.784755 0.705575 1.182619
H -7.991459 -1.370798 0.367210
H -7.940772 -0.747778 -1.295037
H -9.312232 1.259248 -0.585646
H -9.360012 0.640855 1.077005
H -10.605738 -1.432208 0.276925
H -10.555979 -0.812288 -1.396935
H -11.495593 0.057907 -0.150152


