%chk=000154646.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154646

0 1
 O    2.490900      0.4110000      0.2386000    
 O   -2.588400      -5.422100      0.4610000    
 O  -0.5478000      -4.669900      0.7601000    
 O    8.948500       1.185500     -0.9704000    
 O    7.482100      0.1349000      -2.221500    
 N   -3.133200      0.6329000      -1.146000    
 N   -1.746200      -4.492900      0.4341000    
 N    1.235200     -0.1940000      8.9500003E-02
 N    7.822800      0.6549000      -1.131300    
 C   -2.989200     -0.6888000     -0.7888000    
 C   -1.937300       1.288100      -1.024300    
 C   -1.652800     -0.8736000     -0.4280000    
 C   -1.001200      0.3821000     -0.5818000    
 C   -4.372600       1.240900      -1.585100    
 C   -3.930000      -1.724300     -0.7576000    
 C   -1.232500      -2.153700     -1.5400000E-02
 C   -1.798300       2.725900      -1.343300    
 C   -5.153200       1.796200     -0.4245000    
 C   -2.162600      -3.198900      2.0800000E-02
 C   -3.490100      -2.985300     -0.3451000    
 C   0.3788000      0.6923000     -0.3313000    
 C   -4.942900       3.108800     -2.4200000E-02
 C   -6.073700      0.9888000      0.2299000    
 C   -5.666600       3.623700       1.051400    
 C   -6.797400       1.504000       1.305400    
 C   -6.593800       2.821400       1.716000    
 C    3.403700     -0.5747000      0.6972000    
 C    4.757100      5.1100001E-02  0.8644000    
 C    5.649000      5.8800001E-02 -0.2022000    
 C    5.106700      0.6190000       2.084500    
 C    6.906700      0.6419000     -4.6700001E-02
 C    6.364100       1.202100       2.240100    
 C    7.264100       1.213700       1.174400    
 H   -4.960500      0.4829000      -2.116900    
 H   -4.173600       2.006700      -2.339500    
 H   -4.960600      -1.583800      -1.060100    
 H  -0.1971000      -2.313200      0.2679000    
 H   -2.439000       3.065800      -2.158800    
 H  -0.7770000       2.952200      -1.668300    
 H   -1.991500       3.334200     -0.4548000    
 H   -4.224100      -3.788100     -0.3277000    
 H   0.7107000       1.731400     -0.5021000    
 H   -4.250300       3.759200     -0.5465000    
 H   -6.262400     -3.1500001E-02 -8.4100001E-02
 H   -5.513700       4.651800       1.366600    
 H   -7.523000      0.8809000       1.820200    
 H   -7.159300       3.223100       2.551600    
 H    3.056000     -0.9893000       1.652000    
 H    3.452400      -1.402100     -2.2299999E-02
 H    5.345600     -0.3907000      -1.144700    
 H    4.412600      0.6176000       2.920400    
 H    6.641900       1.647700       3.190900    
 H    8.234700       1.677200       1.332100    


%chk=000154646-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154646

0 1
O 2.582351 0.158605 0.219114
O -2.676835 -5.602686 0.917802
O -0.542221 -4.833602 1.144177
O 7.999458 3.298287 0.213078
O 5.812162 3.589734 -0.357086
N -3.188992 0.399516 -1.181819
N -1.782041 -4.672798 0.812680
N 1.241459 -0.427141 0.105518
N 6.783249 2.875926 0.106132
C -3.044292 -0.912927 -0.710464
C -1.947487 1.062833 -1.103636
C -1.667107 -1.092391 -0.333792
C -0.985846 0.170525 -0.587784
C -4.446351 1.003777 -1.651165
C -4.000782 -1.946513 -0.584568
C -1.237494 -2.336528 0.172677
C -1.802061 2.487330 -1.549779
C -5.119183 1.934192 -0.638561
C -2.203195 -3.357833 0.285421
C -3.568145 -3.183670 -0.081158
C 0.412161 0.483559 -0.371691
C -5.836797 3.064918 -1.100265
C -5.072421 1.665161 0.751768
C -6.507725 3.910783 -0.188383
C -5.738516 2.513488 1.664383
C -6.460201 3.636696 1.197714
C 3.474209 -0.880698 0.751301
C 4.874482 -0.306180 0.846930
C 5.161939 1.012095 0.432818
C 5.920885 -1.115039 1.362015
C 6.486522 1.486518 0.542584
C 7.239349 -0.618085 1.461515
C 7.539453 0.697008 1.050298
H -5.128427 0.174483 -1.914126
H -4.251845 1.554122 -2.589918
H -5.050241 -1.802629 -0.859123
H -0.200387 -2.506430 0.466939
H -1.970080 2.595982 -2.639136
H -0.788595 2.860033 -1.335665
H -2.522108 3.150912 -1.036154
H -4.256798 -4.023051 0.040671
H 0.779588 1.493273 -0.611532
H -5.872328 3.287185 -2.174615
H -4.511825 0.799675 1.123039
H -7.058912 4.782827 -0.557069
H -5.694250 2.298152 2.737620
H -6.975795 4.293470 1.906703
H 3.108664 -1.203811 1.746243
H 3.451540 -1.760937 0.078572
H 4.378075 1.658187 0.034001
H 5.704080 -2.140108 1.686797
H 8.033342 -1.257159 1.860637
H 8.548017 1.112760 1.114139


