%chk=000097070.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097070

0 1
 O    2.776600       2.295600     -0.6964000    
 C   -2.233400     -0.3933000      -1.757100    
 C   -1.179100      0.1567000     -0.8194000    
 C   -1.732700      0.4037000      0.4571000    
 C   -3.454200     -0.4299000     -0.8616000    
 C   -3.133800      4.2399999E-02  0.4310000    
 C   0.1540000      0.4105000      -1.090700    
 C  -0.9471000      0.9110000       1.478400    
 C   0.9456000      0.9220000     -6.1000001E-02
 C   -4.733400     -0.8496000      -1.181600    
 C   -4.101800      9.7499996E-02   1.419800    
 C   0.4007000       1.169800       1.210800    
 C   -5.709000     -0.7940000     -0.1847000    
 C   -5.396400     -0.3252000       1.103100    
 C    2.351700       1.202800     -0.3058000    
 C    3.382900      0.1580000     -7.2200000E-02
 C    2.981700      -1.086900      0.3649000    
 C    4.707100      0.4680000     -0.3000000    
 C    3.949500      -2.067100      0.5845000    
 C    5.674900     -0.5122000     -8.0600001E-02
 C    5.296100      -1.779700      0.3616000    
 H   -1.967400      -1.400400      -2.091100    
 H   -2.392200      0.2838000      -2.601400    
 H   0.5653000      0.2161000      -2.076000    
 H   -1.353300       1.107300       2.465000    
 H   -4.976000      -1.211500      -2.174600    
 H   -3.875900      0.4568000       2.418200    
 H    1.028100       1.569000       2.004800    
 H   -6.723200      -1.116600     -0.4050000    
 H   -6.173300     -0.2915000       1.862500    
 H    1.947400      -1.354500      0.5509000    
 H    5.030800       1.445600     -0.6441000    
 H    3.655200      -3.054300      0.9289000    
 H    6.723600     -0.2889000     -0.2539000    
 H    6.049800      -2.542900      0.5325000    


%chk=000097070-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000097070

0 1
O 2.584697 0.959004 -2.139087
C -2.701983 0.076603 -1.973965
C -1.432846 0.118583 -1.130882
C -1.769374 0.048976 0.259244
C -3.804252 -0.025988 -0.926046
C -3.234177 -0.040761 0.385065
C -0.097284 0.214933 -1.535175
C -0.753119 0.081265 1.240469
C 0.936275 0.221550 -0.553363
C -5.197658 -0.101088 -1.096608
C -4.060192 -0.130936 1.528385
C 0.594031 0.160316 0.828791
C -6.025592 -0.191868 0.050639
C -5.460332 -0.206484 1.351288
C 2.350679 0.383132 -1.027050
C 3.500546 -0.132996 -0.203868
C 3.396153 -1.280463 0.628025
C 4.760166 0.511963 -0.337850
C 4.528618 -1.764077 1.319930
C 5.884607 0.039591 0.366985
C 5.771660 -1.100706 1.199744
H -2.707968 -0.786385 -2.668267
H -2.809328 0.983841 -2.600477
H 0.188807 0.294435 -2.589470
H -0.999653 0.052486 2.307488
H -5.643166 -0.090141 -2.097973
H -3.629308 -0.142648 2.535875
H 1.386791 0.212440 1.581843
H -7.113435 -0.251331 -0.066789
H -6.117498 -0.276858 2.225188
H 2.442765 -1.813407 0.705655
H 4.831681 1.376267 -1.006484
H 4.442939 -2.659008 1.946160
H 6.848094 0.551234 0.266488
H 6.647456 -1.473373 1.742894


