%chk=000079549.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079549

0 1
 O    2.116200      -1.534100      9.9999997E-05
 O   -2.115900      -1.534200     -1.5000000E-03
 O    3.514600      0.2944000      3.9999999E-04
 O   -3.514600      0.2940000      3.3000000E-03
 N  -9.9999997E-05 -0.1220000     -1.2000001E-03
 C    1.148600      0.5906000     -7.9999998E-04
 C   -1.148800      0.5907000     -1.0000000E-03
 C    1.202400       1.975100     -3.0000001E-04
 C   -1.202700       1.975200     -9.9999997E-05
 C  -1.9999999E-04   2.673200      9.9999997E-05
 C    2.373900     -0.1898000     -5.0000002E-04
 C   -2.373900     -0.1900000      8.9999998E-04
 C    3.247700      -2.411300      1.9000000E-03
 C   -3.247200      -2.411700     -1.3000000E-03
 H    2.141900       2.517400      9.9999997E-05
 H   -2.142200       2.517500      6.0000003E-04
 H  -1.9999999E-04   3.759000      7.9999998E-04
 H    3.849600      -2.251600     -0.8975000    
 H    2.880400      -3.441000      2.2000000E-03
 H    3.847800      -2.250400      0.9023000    
 H   -3.849600      -2.250100     -0.9001000    
 H   -3.847000      -2.253000      0.8997000    
 H   -2.879700      -3.441200     -3.4000000E-03


%chk=000079549-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000079549

0 1
O 2.334001 -1.598693 0.001194
O -2.333752 -1.598986 -0.000903
O 3.593274 0.358462 0.001654
O -3.593269 0.358012 -0.000573
N 0.000037 -0.198329 0.000432
C 1.164018 0.511165 0.001253
C -1.164032 0.511019 -0.000523
C 1.214146 1.930320 0.001085
C -1.214339 1.930168 -0.000697
C -0.000141 2.648088 0.000100
C 2.478257 -0.225343 0.002532
C -2.478178 -0.225653 -0.001536
C 3.603033 -2.368073 0.000478
C -3.602691 -2.368521 -0.000345
H 2.189575 2.424412 0.001796
H -2.189829 2.424139 -0.001482
H -0.000211 3.742331 -0.000036
H 4.195336 -2.126118 -0.898045
H 3.285700 -3.419297 -0.000498
H 4.195325 -2.127769 0.899452
H -4.195202 -2.127798 -0.899062
H -4.194829 -2.127131 0.898437
H -3.285228 -3.419706 -0.000011


