%chk=000072846.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072846

0 1
 O    2.337100       2.170000      2.2000000E-03
 N    3.179200     -4.0000002E-03 -5.0000002E-04
 N    1.760400      -1.892500     -3.0000001E-04
 N    4.498900      0.4290000     -1.4000000E-03
 C   0.8048000      0.3790000      3.0000001E-04
 C   -1.608000      0.6753000     -3.0000001E-04
 C   -1.770100     -0.7298000      5.0000002E-04
 C   0.6585000      -1.014800      3.9999999E-04
 C  -0.3139000       1.219100     -3.0000001E-04
 C  -0.6325000      -1.555600      6.9999998E-04
 C    2.172600      0.9547000      5.0000002E-04
 C   -2.746600       1.497800     -1.1000000E-03
 C   -3.066100      -1.271000      8.9999998E-04
 C   -4.026500      0.9430000     -1.1000000E-03
 C   -4.186100     -0.4391000      9.9999997E-05
 C    2.938300      -1.361200     -6.9999998E-04
 H  -0.1865000       2.299800     -7.9999998E-04
 H  -0.7513000      -2.638700      8.9999998E-04
 H   -2.646000       2.581200     -1.8000000E-03
 H   -3.215000      -2.348800      1.6000000E-03
 H    3.841500      -1.992000     -1.4000000E-03
 H   -4.898400       1.590700     -1.7000000E-03
 H   -5.182500     -0.8711000      3.0000001E-04
 H    4.622400       1.026800     -0.8178000    
 H    4.623700       1.026500      0.8150000    


%chk=000072846-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000072846

0 1
O 2.439071 2.230557 -0.000792
N 3.206064 0.019385 -0.000516
N 1.763541 -1.913029 0.000120
N 4.574792 0.437418 -0.000553
C 0.803744 0.403449 -0.000462
C -1.636494 0.690881 -0.000336
C -1.799046 -0.757112 0.000060
C 0.648076 -1.039973 -0.000065
C -0.321201 1.238705 -0.000566
C -0.642825 -1.590754 0.000190
C 2.158984 0.995199 -0.000738
C -2.806568 1.524038 -0.000478
C -3.128566 -1.302878 0.000319
C -4.082484 0.960865 -0.000225
C -4.243467 -0.464876 0.000181
C 2.958732 -1.364158 -0.000064
H -0.169031 2.324025 -0.000833
H -0.739908 -2.681235 0.000499
H -2.680203 2.613025 -0.000789
H -3.253031 -2.391945 0.000632
H 3.865616 -1.974791 0.000112
H -4.968604 1.604801 -0.000351
H -5.251788 -0.893360 0.000383
H 4.756329 1.002689 -0.844408
H 4.756167 1.003374 0.842880


