%chk=000100151.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100151

0 1
 O   0.4245000      0.8602000      0.5159000    
 O   -1.149700      -1.503100      6.1600000E-02
 O   0.1032000      -3.747700     -0.8797000    
 O   -3.844500      -1.303100     -0.1766000    
 O  -0.8068000       3.276900      0.5808000    
 O    4.978400      0.2405000      -1.869000    
 O    6.565100     -0.2215000      0.3660000    
 O   -5.891900      -2.284300     -0.4784000    
 C   0.9213000     -0.4623000      0.7872000    
 C   0.2692000      -1.472400     -0.1705000    
 C    2.428600     -0.3965000      0.6713000    
 C   -1.697500     -0.2534000      0.1399000    
 C  -0.9333000      0.8924000      0.3503000    
 C   0.7688000      -2.899300      3.7599999E-02
 C   -3.081800     -0.1306000      1.6600000E-02
 C   -1.546000       2.147100      0.3924000    
 C   -3.710300       1.111700      7.0000000E-02
 C    3.021300     -0.1054000     -0.5571000    
 C    3.224600     -0.6281000       1.792900    
 C   -2.932300       2.257200      0.2538000    
 C    4.410800     -4.5800000E-02 -0.6641000    
 C    4.614000     -0.5685000       1.686000    
 C   -5.155300       1.176700     -7.1400002E-02
 C    5.207100     -0.2772000      0.4575000    
 C   -5.865700      6.0500000E-02 -0.2504000    
 C   -5.228100      -1.266900     -0.3130000    
 C  -0.3093000       3.927000     -0.5866000    
 C    5.215500       1.615800      -2.163200    
 H   0.6412000     -0.7019000       1.823300    
 H   0.4079000      -1.189300      -1.223200    
 H    1.845000      -2.985500     -0.1359000    
 H   0.5357000      -3.250400       1.048500    
 H    2.410700      8.3999999E-02  -1.436200    
 H    2.777000     -0.8566000       2.756400    
 H   -3.398900       3.239000      0.2954000    
 H    5.228900     -0.7499000       2.563300    
 H   -5.645200       2.143200     -2.8999999E-02
 H   0.4302000      -4.650400     -0.7254000    
 H   -6.944300      0.1025000     -0.3564000    
 H   0.2632000       4.804100     -0.2728000    
 H   -1.136100       4.257900      -1.222900    
 H   0.3528000       3.259700      -1.147600    
 H    6.805700     -4.8500001E-02 -0.5605000    
 H    4.269400       2.164400      -2.209600    
 H    5.873600       2.066100      -1.413300    
 H    5.703800       1.677900      -3.139400    


%chk=000100151-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000100151

0 1
O 0.426231 0.953828 0.566334
O -1.074207 -1.452950 0.001579
O 0.184639 -3.723238 -0.953405
O -3.773896 -1.331693 -0.332894
O -0.980305 3.455523 0.699014
O 5.292791 0.743774 -1.537911
O 6.712527 -0.045579 0.579290
O -5.741979 -2.476657 -0.721110
C 0.998827 -0.411655 0.853572
C 0.404841 -1.402860 -0.167315
C 2.500018 -0.290940 0.787478
C -1.694670 -0.197216 0.070389
C -0.958726 0.986957 0.327300
C 0.849189 -2.859329 0.016096
C -3.097939 -0.134604 -0.093292
C -1.627835 2.253660 0.377379
C -3.773350 1.116558 -0.014720
C 3.122565 0.199045 -0.394071
C 3.296304 -0.686038 1.885797
C -3.018769 2.300756 0.207388
C 4.522700 0.278895 -0.454092
C 4.706393 -0.611982 1.821445
C -5.209419 1.104739 -0.183885
C 5.323942 -0.131252 0.654571
C -5.897185 -0.067142 -0.417044
C -5.228463 -1.362353 -0.510208
C 0.243735 3.812648 -0.050883
C 4.586260 1.157095 -2.752861
H 0.671226 -0.702451 1.871035
H 0.621380 -1.064060 -1.200437
H 1.927908 -2.956866 -0.181257
H 0.637982 -3.180423 1.058832
H 2.504855 0.535482 -1.232445
H 2.818889 -1.051585 2.801726
H -3.513455 3.274829 0.264554
H 5.335295 -0.914507 2.663105
H -5.752085 2.055238 -0.123720
H -0.795320 -3.591359 -0.860429
H -6.982151 -0.087600 -0.545621
H 0.509124 4.816622 0.312875
H 0.032092 3.851175 -1.137216
H 1.057299 3.099238 0.155977
H 6.960658 0.315088 -0.313816
H 4.002856 0.316408 -3.173769
H 3.918007 2.015081 -2.548041
H 5.371719 1.457901 -3.460793


