%chk=000076760.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076760

0 1
 O   0.2539000       2.069700     -1.4000000E-03
 O   -2.264900      -2.643300      1.4000000E-03
 O    4.841600      0.1848000     -1.3000000E-03
 N    2.605400      0.9288000      3.0000001E-04
 C   0.4636000     -0.2906000     -6.9999998E-04
 C  -0.2037000      -1.517400     -5.0000002E-04
 C   -1.773100      0.9259000     -5.0000002E-04
 C   -2.440300     -0.3009000     -9.9999997E-05
 C  -0.2967000      0.9758000     -8.9999998E-04
 C    1.863200     -0.2569000     -1.9999999E-04
 C   -1.679900      -1.567400      3.9999999E-04
 C   0.5289000      -2.710600     -5.0000002E-04
 C    2.589200      -1.448400      1.9999999E-04
 C   -2.505600       2.119000     -3.0000001E-04
 C   -3.839900     -0.3345000      1.9999999E-04
 C    1.923600      -2.672500      9.9999997E-05
 C   -3.900200       2.081000      5.0000002E-04
 C   -4.566000      0.8569000      5.0000002E-04
 C    3.996700       1.074300      1.3000000E-03
 C    4.404200       2.526300      1.7000000E-03
 H   3.3500001E-02  -3.677700     -3.9999999E-04
 H    3.663900      -1.535100      1.1000000E-03
 H   -2.012600       3.087500     -5.0000002E-04
 H   -4.382600      -1.276000      3.9999999E-04
 H    2.489300      -3.599900      3.9999999E-04
 H    2.067700       1.790600      3.0000001E-04
 H   -4.467900       3.007100      7.9999998E-04
 H   -5.651800      0.8301000      7.9999998E-04
 H    4.032200       3.014800     -0.9033000    
 H    5.494700       2.605300      2.5800001E-02
 H    3.993300       3.027000      0.8829000    


%chk=000076760-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000076760

0 1
O 0.327192 2.121269 0.003578
O -2.319239 -2.721777 -0.002033
O 4.887775 0.224655 0.004766
N 2.629363 0.909407 0.001714
C 0.497685 -0.298378 0.001020
C -0.206623 -1.548144 -0.000076
C -1.749832 0.923258 0.001207
C -2.449714 -0.316540 -0.000092
C -0.260406 0.971339 0.002048
C 1.943158 -0.315678 0.001231
C -1.703722 -1.607887 -0.000537
C 0.495895 -2.769948 -0.000728
C 2.632131 -1.565714 0.000708
C -2.478419 2.139231 0.001793
C -3.865794 -0.327237 -0.000829
C 1.908272 -2.769716 -0.000261
C -3.887043 2.121054 0.001067
C -4.583086 0.885245 -0.000265
C 4.014331 1.139621 0.001454
C 4.373246 2.622010 -0.001044
H -0.081798 -3.698698 -0.001508
H 3.723493 -1.555716 0.001116
H -1.918095 3.078750 0.002833
H -4.374712 -1.296145 -0.001812
H 2.454199 -3.718864 -0.000719
H 1.982896 1.730509 0.001690
H -4.445763 3.062787 0.001508
H -5.678013 0.874283 -0.000827
H 3.987749 3.119153 -0.909909
H 5.467190 2.723577 0.027655
H 3.937383 3.137993 0.873754


