%chk=000150358.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150358

0 1
 O   -2.605000       3.306700       1.096500    
 O   -2.607000       3.305100      -1.098700    
 O    5.311700      0.2133000      -1.097400    
 O    5.311600      0.2114000       1.097800    
 N   -2.606200       2.701000     -6.0000003E-04
 N    4.738800      3.0400001E-02  9.9999997E-05
 C   0.9564000     -3.5000001E-03   0.000000    
 C   -1.710700     -0.9733000      1.9999999E-04
 C   -1.471700      0.4267000      3.9999999E-04
 C  -0.1260000      0.9160000      5.0000002E-04
 C   0.7173000      -1.403400     -1.9999999E-04
 C  -0.6284000      -1.892800     -9.9999997E-05
 C    2.300300      0.4851000       0.000000    
 C   -3.054700      -1.462000      3.9999999E-04
 C   -2.605900       1.277900      5.0000002E-04
 C    1.851500      -2.254600     -7.9999998E-04
 C   0.1966000       2.296900      7.9999998E-04
 C  -0.9510000      -3.273700     -9.9999997E-05
 C    3.378700     -0.4013000     -5.0000002E-04
 C    2.557500       1.857200      3.0000001E-04
 C   -4.133000     -0.5755000      3.9999999E-04
 C   -3.311800      -2.834100      1.9999999E-04
 C    3.155900      -1.766500     -8.9999998E-04
 C   -3.910300      0.7897000      3.9999999E-04
 C    1.509900       2.760600      6.9999998E-04
 C   -2.264400      -3.737500       0.000000    
 H    1.748600      -3.336400     -1.2000001E-03
 H  -0.4901000       3.119000      8.9999998E-04
 H  -0.1775000      -4.037000     -1.9999999E-04
 H    3.564400       2.266300      1.9999999E-04
 H   -5.158400     -0.9392000      3.9999999E-04
 H   -4.331200      -3.214300      1.9999999E-04
 H    3.983200      -2.472400     -1.2000001E-03
 H   -4.771000       1.455700      3.0000001E-04
 H    1.712000       3.828000      7.9999998E-04
 H   -2.463900      -4.805000     -9.9999997E-05


%chk=000150358-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000150358

0 1
O -2.687381 3.370208 1.141864
O -2.687317 3.370151 -1.141838
O 5.383366 0.210120 -1.142814
O 5.385222 0.204571 1.142279
N -2.656732 2.772588 0.000027
N 4.819389 0.016172 -0.000269
C 0.985738 0.019412 -0.000036
C -1.745014 -0.960680 0.000050
C -1.508262 0.476127 0.000112
C -0.104505 0.977466 0.000171
C 0.743179 -1.403763 -0.000147
C -0.648234 -1.901229 -0.000018
C 2.355031 0.502427 -0.000111
C -3.098381 -1.485924 0.000063
C -2.671678 1.283093 0.000059
C 1.841470 -2.290476 -0.000349
C 0.228972 2.350443 0.000414
C -0.931704 -3.284439 0.000039
C 3.410957 -0.461100 -0.000263
C 2.630936 1.904770 0.000041
C -4.213339 -0.591571 0.000037
C -3.331122 -2.896368 0.000089
C 3.179207 -1.831429 -0.000335
C -4.000757 0.778831 0.000008
C 1.572471 2.807171 0.000343
C -2.256980 -3.785493 0.000100
H 1.682823 -3.370314 -0.000490
H -0.527735 3.128042 0.000704
H -0.115941 -4.010965 0.000042
H 3.664832 2.263121 -0.000102
H -5.230049 -0.997183 0.000022
H -4.364130 -3.260735 0.000103
H 4.012279 -2.539985 -0.000392
H -4.837327 1.483718 -0.000047
H 1.764737 3.884282 0.000502
H -2.427821 -4.866561 0.000143


