%chk=000078562.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078562

0 1
 O    3.900000       1.561500     -1.1200000E-02
 O   -1.879500      -1.580300     -9.2000002E-03
 N   -3.131300      0.3668000      1.6000000E-03
 N  -0.7770000      0.4684000      6.9999998E-04
 C   0.5808000      6.2500000E-02  2.4000001E-03
 C   -1.910800     -0.3479000      4.8000002E-03
 C    1.573800       1.026700     -4.3000001E-03
 C   0.8823000      -1.288300      8.8999998E-03
 C    2.910400      0.6273000     -4.4000000E-03
 C   -4.423600     -0.3064000     -1.8500000E-02
 C   -3.176300       1.827500      1.8100001E-02
 C    2.218600      -1.687700      8.8000000E-03
 C    3.232700     -0.7300000      2.3000001E-03
 H  -0.9021000       1.474700     -4.4999998E-03
 H    1.320300       2.083700     -9.8000001E-03
 H   0.1668000      -2.095500      1.6400000E-02
 H   -4.970100      5.7000001E-03 -0.9131000    
 H   -4.983600     -2.1700000E-02  0.8770000    
 H   -4.304100      -1.392500     -3.4100000E-02
 H   -4.212600       2.177700      4.4000000E-02
 H   -2.694900       2.214200     -0.8850000    
 H   -2.657900       2.198300      0.9073000    
 H    2.471400      -2.744100      1.4600000E-02
 H    4.271900      -1.047300      2.3000001E-03
 H    3.497900       2.447100     -1.5200000E-02


%chk=000078562-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000078562

0 1
O 3.960563 1.572136 -0.005255
O -1.969707 -1.599739 -0.007194
N -3.160225 0.417495 0.002147
N -0.799813 0.450415 -0.001504
C 0.546983 -0.006711 -0.000045
C -1.972139 -0.329277 0.000295
C 1.559226 0.994472 -0.003470
C 0.913819 -1.378090 0.004932
C 2.920438 0.621568 -0.001873
C -4.439091 -0.310384 -0.013042
C -3.197460 1.886429 0.013763
C 2.285167 -1.716913 0.006705
C 3.300334 -0.739245 0.003387
H -0.907886 1.464784 -0.008295
H 1.280431 2.058783 -0.007249
H 0.133833 -2.139670 0.006740
H -5.029652 -0.056593 -0.914369
H -5.039892 -0.075282 0.886547
H -4.216835 -1.388019 -0.022563
H -4.248088 2.215737 0.037712
H -2.739293 2.329066 -0.895324
H -2.704260 2.313045 0.911659
H 2.566203 -2.775954 0.010692
H 4.361792 -1.000387 0.004665
H 3.598652 2.492735 -0.009163


