%chk=000101087.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101087

0 1
 O   -2.601000      -1.226300     -0.6411000    
 O   -2.519500      -2.348600       1.374900    
 C   -2.464200      0.9038000      0.5334000    
 C   -1.464500       1.351000     -0.5540000    
 C   -3.259600       2.062500       1.175700    
 C  -0.4055000       2.335100     -4.6300001E-02
 C   -3.381500     -0.1902000     -3.7000000E-02
 C    2.065500      -1.544400     -0.5816000    
 C   0.7802000      -2.141600     -3.3000000E-03
 C   0.5706000       2.785400      -1.136600    
 C  -0.1223000      -2.691500      -1.113000    
 C    3.001800     -0.9672000      0.4841000    
 C   -4.111200       2.875800      0.2105000    
 C   -1.427500      -3.267700     -0.5715000    
 C    4.275200     -0.3473000     -9.5700003E-02
 C   -2.239300      -2.247200      0.1875000    
 C    5.204800      0.1468000       1.013600    
 C    1.608800       3.782300     -0.6452000    
 C    6.489400      0.7293000      0.4457000    
 H   -1.868600      0.4429000       1.333600    
 H   -2.003400       1.795300      -1.399500    
 H  -0.9310000      0.4824000     -0.9567000    
 H   -2.576900       2.736200       1.705000    
 H   -3.919200       1.644500       1.946900    
 H   0.1561000       1.872000      0.7743000    
 H  -0.8900000       3.229000      0.3609000    
 H   -4.056800     -0.5887000      0.7298000    
 H   -4.015300      0.2143000     -0.8329000    
 H    2.600500      -2.316300      -1.148600    
 H    1.805700     -0.7512000      -1.293600    
 H    1.031200      -2.945300      0.6993000    
 H   0.2566000      -1.365600      0.5664000    
 H    1.087100       1.908800      -1.545600    
 H   9.3000000E-03   3.238300      -1.962600    
 H    3.273000      -1.765100       1.186500    
 H    2.462500     -0.2062000       1.062100    
 H  -0.3391000      -1.895200      -1.835200    
 H   0.4104000      -3.478500      -1.660400    
 H   -4.862100       2.256900     -0.2881000    
 H   -3.499200       3.365500     -0.5521000    
 H   -4.643800       3.660600      0.7583000    
 H   -2.044500      -3.663100      -1.386100    
 H   -1.215600      -4.105500      0.1031000    
 H    4.797500      -1.092700     -0.7075000    
 H    4.009500      0.4861000     -0.7572000    
 H    4.695500      0.9109000       1.612400    
 H    5.454800     -0.6808000       1.687400    
 H    1.129500       4.688800     -0.2622000    
 H    2.215500       3.349100      0.1565000    
 H    2.277800       4.068800      -1.462400    
 H    6.277600       1.579800     -0.2102000    
 H    7.039300     -2.1199999E-02 -0.1310000    
 H    7.138000       1.077900       1.255500    


%chk=000101087-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000101087

0 1
O -2.618999 -1.310831 -0.755505
O -2.880320 -2.273388 1.354523
C -2.447969 0.901440 0.401546
C -1.354056 1.422553 -0.567199
C -3.286589 2.024857 1.080683
C -0.231629 2.233275 0.119468
C -3.381680 -0.108414 -0.297723
C 1.988376 -1.620845 -0.591980
C 0.715918 -2.221352 0.045874
C 0.901096 2.636269 -0.852990
C -0.204714 -2.910117 -0.986890
C 2.904361 -0.903816 0.425811
C -4.083777 2.940150 0.121503
C -1.536325 -3.425580 -0.379538
C 4.131994 -0.228694 -0.225805
C -2.401863 -2.314721 0.196930
C 5.056527 0.479002 0.790992
C 2.035436 3.425529 -0.164293
C 6.263719 1.174132 0.125382
H -1.942736 0.347944 1.221170
H -1.817721 2.037842 -1.365896
H -0.900211 0.550189 -1.079125
H -2.606162 2.649993 1.690450
H -3.987604 1.551457 1.797626
H 0.197516 1.632179 0.949408
H -0.648585 3.150584 0.582620
H -4.185196 -0.439981 0.384864
H -3.808500 0.293242 -1.231515
H 2.561665 -2.422268 -1.103620
H 1.688905 -0.900695 -1.382838
H 0.999708 -2.947296 0.835696
H 0.156521 -1.410446 0.557026
H 1.318708 1.721815 -1.322928
H 0.473809 3.241621 -1.678644
H 3.246108 -1.631736 1.191252
H 2.313923 -0.136142 0.969918
H -0.437627 -2.203189 -1.805091
H 0.328168 -3.768575 -1.442260
H -4.839256 2.377880 -0.457985
H -3.420514 3.453413 -0.597984
H -4.621386 3.719995 0.691193
H -2.120275 -3.944246 -1.164584
H -1.347237 -4.146146 0.434913
H 4.717519 -0.988117 -0.785632
H 3.784514 0.511688 -0.977254
H 4.466677 1.227653 1.359390
H 5.416671 -0.261323 1.534410
H 1.648140 4.350105 0.304303
H 2.510864 2.820557 0.631281
H 2.823289 3.715812 -0.883765
H 5.927842 1.942945 -0.596341
H 6.885990 0.445085 -0.427446
H 6.909065 1.671412 0.872800


