%chk=000096371.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096371

0 1
 O    3.509300       1.405000     -8.9999998E-04
 N   -3.880700      0.5215000      5.0000002E-04
 N    1.145400     -5.5999998E-03 -3.0000001E-04
 N    2.355400     -0.6090000      6.0000003E-04
 N    4.650400     -0.5881000      3.9999999E-04
 C   -1.230500     -0.3674000     -6.0000003E-04
 C   -2.274700      -1.285600     -6.9999998E-04
 C   -1.509800      0.9947000     -9.9999997E-05
 C   0.1478000     -0.8298000      1.9999999E-04
 C   -3.570300     -0.7943000       0.000000    
 C   -2.839600       1.384000      5.0000002E-04
 C    3.497200      0.1748000      3.0000001E-04
 H   -2.095900      -2.355600     -8.9999998E-04
 H  -0.7326000       1.751300      1.9999999E-04
 H   0.3029000      -1.925200      1.2000001E-03
 H   -4.420100      -1.468900      1.9999999E-04
 H   -3.111000       2.434700      1.0000000E-03
 H    2.396700      -1.623000      1.5000000E-03
 H    5.567700     -0.1549000     -9.9999997E-05
 H    4.616900      -1.602000      1.3000000E-03


%chk=000096371-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096371

0 1
O 3.489736 1.435367 0.000163
N -3.937285 0.586282 0.000079
N 1.153647 -0.126014 0.000017
N 2.409895 -0.673782 0.000043
N 4.747081 -0.531728 0.000411
C -1.248201 -0.403532 0.000201
C -2.360305 -1.288400 0.000127
C -1.516723 0.994649 0.000198
C 0.118687 -0.939915 0.000267
C -3.667397 -0.753147 0.000067
C -2.856222 1.430559 0.000129
C 3.548949 0.183081 -0.000127
H -2.213346 -2.375081 0.000090
H -0.686815 1.707124 0.000226
H 0.222570 -2.045198 0.000519
H -4.541621 -1.414373 0.000009
H -3.093454 2.500318 0.000124
H 2.537082 -1.698167 0.000294
H 5.603828 0.016144 0.000827
H 4.814395 -1.547589 0.000636


