%chk=000051180.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051180

0 1
 O    1.338900       1.107300       2.295100    
 N   -2.066200      0.1109000      0.1358000    
 N   0.3539000       1.689500      0.2520000    
 C   -1.162200       1.509900      -1.741700    
 C   -1.975800       2.614400      0.3070000    
 C   -1.934800       2.719900      -1.217500    
 C   -1.895900      0.2172000      -1.320400    
 C   -2.698400       1.308900      0.7074000    
 C   0.2848000       1.557500      -1.214500    
 C  -0.5399000       2.683500      0.8575000    
 C   -2.805000      -1.096700      0.4933000    
 C    1.263700       1.012300       1.071200    
 C   -2.041400      -2.339800      3.9799999E-02
 C   -2.788100      -3.617800      0.4237000    
 C    2.216300      9.7499996E-02  0.4327000    
 C   -2.052000      -4.858700     -5.5500001E-02
 C    3.453600      0.5731000      6.6000000E-03
 C    1.878600      -1.241800      0.2567000    
 C    4.359600     -0.2967000     -0.6003000    
 C    2.784700      -2.111600     -0.3501000    
 C    4.025200      -1.638900     -0.7786000    
 H   -1.132800       1.549400      -2.837600    
 H   -2.543200       3.461200      0.7119000    
 H   -1.450400       3.653300      -1.528600    
 H   -2.951700       2.732900      -1.628300    
 H   -2.870800      0.1803000      -1.824900    
 H   -1.290200     -0.6041000      -1.713900    
 H   -2.700900       1.233800       1.801900    
 H   -3.746900       1.373400      0.3866000    
 H   0.8295000      0.6778000      -1.564600    
 H   0.7987000       2.435200      -1.625700    
 H  -0.1050000       3.666500      0.6378000    
 H  -0.5500000       2.575100       1.947400    
 H   -3.811500      -1.089300      5.5300001E-02
 H   -2.926000      -1.144600       1.582900    
 H   -1.050900      -2.360400      0.5002000    
 H   -1.910500      -2.369800      -1.045600    
 H   -3.793900      -3.607700     -1.2300000E-02
 H   -2.906600      -3.667000       1.512400    
 H   -2.600300      -5.760300      0.2351000    
 H   -1.951000      -4.859800      -1.145500    
 H   -1.050300      -4.914200      0.3826000    
 H    3.723300       1.617300      0.1406000    
 H   0.9257000      -1.620000      0.6037000    
 H    5.325500      7.1199998E-02 -0.9339000    
 H    2.525700      -3.157700     -0.4851000    
 H    4.731000      -2.316400      -1.250200    


%chk=000051180-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000051180

0 1
O 0.764934 0.682541 2.291810
N -2.055881 0.190474 -0.015702
N 0.394798 1.790942 0.270579
C -1.140020 1.760105 -1.745987
C -1.966635 2.679620 0.403049
C -1.939690 2.926941 -1.123199
C -1.884388 0.431769 -1.466130
C -2.680557 1.336711 0.690984
C 0.321185 1.774703 -1.208036
C -0.517227 2.740435 0.949407
C -2.752473 -1.079077 0.298545
C 1.009781 0.810644 1.046008
C -2.005973 -2.344214 -0.172813
C -2.631739 -3.634691 0.405037
C 2.031780 -0.093975 0.398390
C -1.936003 -4.915141 -0.104632
C 3.065002 0.396106 -0.441864
C 2.027512 -1.465494 0.759055
C 4.064869 -0.475506 -0.928211
C 3.014977 -2.340037 0.258423
C 4.036488 -1.848087 -0.588944
H -1.075588 1.885557 -2.845695
H -2.540986 3.480615 0.909710
H -1.463041 3.900310 -1.353653
H -2.967012 2.953455 -1.535876
H -2.875742 0.468979 -1.998673
H -1.315269 -0.410771 -1.899514
H -2.651469 1.121793 1.775876
H -3.761535 1.453077 0.401757
H 0.861229 0.892147 -1.583859
H 0.825318 2.679498 -1.612114
H -0.129223 3.771344 0.805632
H -0.484889 2.499522 2.024779
H -3.793645 -1.089034 -0.126847
H -2.858373 -1.125910 1.400468
H -0.946326 -2.266459 0.140327
H -2.011156 -2.413589 -1.279059
H -3.709654 -3.670589 0.143882
H -2.580128 -3.600379 1.512290
H -2.389722 -5.823829 0.332031
H -2.010098 -4.995395 -1.205760
H -0.861378 -4.912572 0.158658
H 3.104411 1.462786 -0.691303
H 1.256276 -1.821054 1.450409
H 4.866900 -0.083554 -1.563756
H 2.996874 -3.399721 0.536746
H 4.809588 -2.524996 -0.969827


