%chk=000050012.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050012

0 1
 I    6.480100       1.706200     -5.9599999E-02
 O  -0.1532000     -0.3984000     -2.9899999E-02
 O   -1.702500      -2.103500      8.1500001E-02
 C   -4.863300      0.9074000     -9.2299998E-02
 C   -3.866500     -0.2518000      4.9000001E-03
 C   -6.302900      0.4126000      4.8599999E-02
 C   -2.414800      0.2154000     -9.8899998E-02
 C   -7.295100       1.563500     -2.0000001E-03
 C   -1.416500     -0.9179000     -1.3800000E-02
 C   0.9075000      -1.353500      7.5900003E-02
 C    2.222200     -0.6310000      4.3499999E-02
 C    2.852900     -0.4029000      -1.174200    
 C    2.797800     -0.1966000       1.232300    
 C    4.075400      0.2684000      -1.203600    
 C    4.020100      0.4748000       1.202800    
 C    4.658900      0.7073000     -1.5100000E-02
 H   -4.739900       1.419000      -1.054400    
 H   -4.647500       1.640300      0.6946000    
 H   -4.009300     -0.7807000      0.9557000    
 H   -4.073700     -0.9795000     -0.7899000    
 H   -6.532400     -0.2980000     -0.7539000    
 H   -6.422700     -0.1210000      0.9986000    
 H   -2.261700      0.7278000      -1.055400    
 H   -2.201700      0.9170000      0.7159000    
 H   -7.113300       2.274500      0.8102000    
 H   -7.223200       2.101600     -0.9526000    
 H   -8.317900       1.187000      9.8800004E-02
 H   0.8469000      -2.067600     -0.7548000    
 H   0.8070000      -1.916300       1.012500    
 H    2.406200     -0.7386000      -2.106000    
 H    2.307800     -0.3708000       2.186200    
 H    4.555900      0.4395000      -2.163600    
 H    4.457000      0.8085000       2.140500    


%chk=000050012-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000050012

0 1
I 5.556065 1.815626 -1.902752
O -0.241268 -0.792804 1.460530
O -1.047194 -1.512705 -0.609825
C -4.725584 0.856881 0.154693
C -3.552954 -0.081266 -0.205503
C -5.920879 0.726744 -0.816845
C -2.369887 0.067033 0.771076
C -7.097661 1.656453 -0.450394
C -1.191089 -0.828137 0.429399
C 1.013025 -1.601763 1.241516
C 2.068818 -0.804292 0.508136
C 2.159550 -0.856464 -0.906193
C 2.985827 0.005657 1.223281
C 3.144367 -0.115160 -1.596545
C 3.975266 0.755816 0.548959
C 4.044986 0.685415 -0.859805
H -4.372786 1.909833 0.157972
H -5.072058 0.641713 1.187595
H -3.901094 -1.132461 -0.205905
H -3.205368 0.125737 -1.235579
H -5.577725 0.949516 -1.847541
H -6.268682 -0.326329 -0.826611
H -2.001403 1.112878 0.779748
H -2.678282 -0.147267 1.812205
H -7.481757 1.430122 0.562339
H -6.783423 2.717347 -0.460045
H -7.936566 1.546423 -1.161833
H 0.735233 -2.514793 0.687551
H 1.323459 -1.849377 2.268553
H 1.445002 -1.467228 -1.468413
H 2.929407 0.057973 2.317076
H 3.205068 -0.164795 -2.687220
H 4.677184 1.376374 1.112881


