%chk=000060980.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060980

0 1
 O   0.6476000       1.330500      0.2965000    
 O    2.401500       2.648200     -0.4011000    
 C   -3.968200       1.198600      0.4701000    
 C   -4.347000     -0.2508000      0.1383000    
 C   -2.602200       1.604800     -4.2300001E-02
 C   -3.377600      -1.247300      0.7114000    
 C   -1.578700       2.011900      0.7335000    
 C   -2.441800       1.562900      -1.540600    
 C   -2.703900      -2.217700      6.5399997E-02
 C  -0.2179000       2.457800      0.3022000    
 C   -1.775400      -3.130800      0.8211000    
 C   -2.774300      -2.490400      -1.410100    
 C    2.732500      0.3145000     -4.2500000E-02
 C    1.935800       1.566900     -7.6600000E-02
 C    4.082600      0.3899000      0.2317000    
 C    2.097600     -0.8861000     -0.2863000    
 C    4.831000     -0.7870000      0.2634000    
 C    2.845900      -2.062900     -0.2544000    
 C    4.212500      -2.013200      2.0400001E-02
 H   -4.721300       1.872500      4.2800002E-02
 H   -4.016400       1.342400       1.557600    
 H   -4.480200     -0.3600000     -0.9405000    
 H   -5.331200     -0.4544000      0.5792000    
 H   -3.238700      -1.163500       1.789000    
 H   -1.737600       2.018500       1.811000    
 H   -3.196900       2.201200      -2.012100    
 H   -2.576700      0.5439000      -1.914300    
 H   -1.469100       1.892300      -1.909000    
 H   0.1502000       3.191600       1.030100    
 H  -0.2214000       2.950100     -0.6748000    
 H  -0.7574000      -3.046100      0.4267000    
 H   -1.736600      -2.896600       1.890200    
 H   -2.102000      -4.171000      0.7208000    
 H   -3.063200      -3.532500      -1.584600    
 H   -3.494300      -1.867200      -1.942700    
 H   -1.793200      -2.325400      -1.868000    
 H    4.574700       1.338300      0.4259000    
 H    1.038200     -0.9509000     -0.5157000    
 H    5.895000     -0.7485000      0.4780000    
 H    2.364900      -3.017700     -0.4464000    
 H    4.795200      -2.929500      4.4599999E-02


%chk=000060980-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000060980

0 1
O 0.683432 1.224372 0.181588
O 2.498104 2.636504 -0.221881
C -3.955126 1.220446 0.636175
C -4.382673 -0.241034 0.276054
C -2.705469 1.691038 -0.099481
C -3.303033 -1.253152 0.601201
C -1.570866 1.977878 0.603879
C -2.828917 1.774981 -1.609029
C -2.773929 -2.218011 -0.204766
C -0.246771 2.407689 0.048202
C -1.659793 -3.124213 0.297593
C -3.205312 -2.487111 -1.636487
C 2.870791 0.253748 0.181428
C 2.044619 1.488987 0.023560
C 4.279438 0.372175 0.059017
C 2.286039 -1.012653 0.445231
C 5.098240 -0.767005 0.201578
C 3.109865 -2.149480 0.586584
C 4.515148 -2.029650 0.465725
H -4.805917 1.893914 0.400979
H -3.786482 1.280991 1.728520
H -4.677682 -0.294615 -0.787405
H -5.298677 -0.467697 0.861560
H -2.891779 -1.165205 1.619989
H -1.592879 1.857935 1.695940
H -3.720916 2.365448 -1.895091
H -2.960310 0.763856 -2.040485
H -1.950271 2.228455 -2.094637
H 0.204317 3.243900 0.612787
H -0.277093 2.687137 -1.018277
H -0.748151 -3.008209 -0.323790
H -1.392127 -2.901841 1.345377
H -1.950973 -4.191853 0.234793
H -3.579983 -3.524975 -1.740768
H -4.000686 -1.808959 -1.987175
H -2.343665 -2.392793 -2.327222
H 4.705883 1.359840 -0.145791
H 1.198437 -1.088026 0.536295
H 6.185662 -0.673798 0.108064
H 2.659496 -3.127094 0.791305
H 5.152006 -2.914617 0.576763


