%chk=000172905.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000172905

0 1
 O    3.700400      -1.359200      -1.387100    
 C   -1.263300      6.5399997E-02  7.6700002E-02
 C    1.190800     -0.5184000      4.8599999E-02
 C   -2.712400     -0.1703000      0.6023000    
 C  -0.1817000     -0.8534000      0.6312000    
 C    1.594900      0.9180000      0.4095000    
 C    2.245700      -1.521800      0.5399000    
 C    2.988600       1.269700     -0.1294000    
 C   -1.368000     -1.0900000E-02  -1.452600    
 C    3.646200      -1.183700      2.7000001E-02
 C    4.036000      0.2565000      0.3594000    
 C   -3.519800      0.3455000     -0.5764000    
 C   -2.776300      0.4205000      -1.689400    
 C   -3.043800      -1.649400      0.8571000    
 C   -2.947800      0.6367000       1.886400    
 C    3.381700       2.688300      0.2808000    
 C   -4.971300      0.6666000     -0.4841000    
 H   -1.016400       1.103700      0.3356000    
 H    1.151000     -0.6021000      -1.044600    
 H  -0.1560000     -0.7766000       1.725200    
 H  -0.4143000      -1.898200      0.3925000    
 H    1.572300       1.049600       1.499300    
 H   0.8975000       1.645000     -1.7100001E-02
 H    2.259100      -1.536300       1.637200    
 H    1.965400      -2.527800      0.2038000    
 H    2.954400       1.237300      -1.226500    
 H   -1.213500      -1.021900      -1.844400    
 H  -0.6647000      0.6747000      -1.935400    
 H    4.378700      -1.868900      0.4680000    
 H    5.001300      0.4905000     -0.1065000    
 H    4.164300      0.3529000       1.445000    
 H   -3.148400      0.7252000      -2.657300    
 H   -2.455800      -2.052600       1.688900    
 H   -2.848200      -2.269300     -2.5300000E-02
 H   -4.100200      -1.779700       1.119700    
 H   -2.810200       1.711500       1.720300    
 H   -2.253000      0.3296000       2.676000    
 H   -3.965100      0.4922000       2.267900    
 H    4.363000       2.952300     -0.1273000    
 H    2.655900       3.417000     -9.5500000E-02
 H    3.429600       2.789700       1.370300    
 H   -5.139400       1.499400      0.2054000    
 H   -5.537900     -0.1997000     -0.1298000    
 H   -5.381200      0.9551000      -1.457800    
 H    3.460900      -2.282200      -1.577300    


%chk=000172905-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000172905

0 1
O 3.846519 -1.293273 -1.404315
C -1.321207 0.066473 -0.060207
C 1.231907 -0.458751 0.007762
C -2.757074 -0.144103 0.567645
C -0.191569 -0.810349 0.518641
C 1.691177 0.956675 0.438253
C 2.253893 -1.509831 0.508302
C 3.123060 1.292140 -0.052842
C -1.531105 -0.065458 -1.600498
C 3.702999 -1.202430 0.070562
C 4.126058 0.225787 0.450559
C -3.672456 0.304483 -0.593997
C -2.991689 0.321429 -1.772574
C -3.060433 -1.636180 0.896225
C -2.935322 0.708603 1.847849
C 3.553056 2.708255 0.382305
C -5.138400 0.600257 -0.395855
H -1.074824 1.131289 0.133670
H 1.230339 -0.492557 -1.102291
H -0.192671 -0.734111 1.628153
H -0.398226 -1.874150 0.277944
H 1.660644 1.023916 1.548967
H 0.989144 1.722625 0.055148
H 2.225943 -1.543620 1.618651
H 1.963490 -2.522019 0.155076
H 3.121787 1.243633 -1.160863
H -1.348743 -1.107009 -1.946131
H -0.842448 0.580249 -2.177710
H 4.393153 -1.935129 0.544715
H 5.133521 0.419372 0.036509
H 4.204769 0.284759 1.556285
H -3.439055 0.553490 -2.746064
H -2.417809 -2.003604 1.717759
H -2.900997 -2.282545 0.014016
H -4.111993 -1.757405 1.218030
H -2.803983 1.785091 1.630703
H -2.188798 0.422277 2.613245
H -3.937965 0.568942 2.294518
H 4.566978 2.950988 0.012392
H 2.857650 3.475636 -0.006851
H 3.566491 2.794961 1.486760
H -5.288389 1.457194 0.289640
H -5.671015 -0.260929 0.054436
H -5.634282 0.841625 -1.352270
H 3.556877 -2.196196 -1.692051


