%chk=000093913.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093913

0 1
 O   0.7281000      0.4138000      -2.324300    
 O    2.116200      -2.534000      0.9559000    
 O  -1.9099999E-02  -1.883600     -0.8144000    
 O   -2.131500      -2.134400     -0.1472000    
 O  -0.8525000     -0.4716000      0.8070000    
 N    1.172100      -1.191800     -0.6968000    
 C    2.787400      0.4146000      -1.040100    
 C    3.257100     -0.5833000      7.1199998E-02
 C    2.744400       1.763100     -0.2875000    
 C    3.416200      0.3340000       1.304100    
 C    2.278200       1.345800       1.113800    
 C    4.173400       2.118500      6.1500002E-02
 C    4.575800       1.262600       1.015100    
 C    1.430100     -9.5200002E-02  -1.464200    
 C    2.130300      -1.582300      0.1906000    
 C  -0.9935000      -1.405100      2.7799999E-02
 C   -3.243700      -1.749800      0.6677000    
 C   -3.599500     -0.3230000      0.3692000    
 C   -4.156500      0.4707000       1.365700    
 C   -3.368600      0.1929000     -0.9013000    
 C   -4.487000       1.797100       1.088400    
 C   -3.699100       1.519400      -1.178500    
 C   -4.258300       2.321500     -0.1836000    
 H    3.464900      0.4172000      -1.901100    
 H    4.180600      -1.102100     -0.2082000    
 H    2.158500       2.563000     -0.7414000    
 H    3.434300     -0.1508000       2.280900    
 H    2.303300       2.168100       1.841600    
 H    1.280400      0.9036000       1.137700    
 H    4.772800       2.880700     -0.4098000    
 H    5.559200       1.208100       1.453600    
 H   -2.984400      -1.903600       1.721700    
 H   -4.088000      -2.400900      0.4190000    
 H   -4.339800      7.1599998E-02   2.359400    
 H   -2.961600     -0.4122000      -1.706400    
 H   -4.923000       2.421500       1.862800    
 H   -3.527000       1.926300      -2.170700    
 H   -4.517000       3.353900     -0.4000000    


%chk=000093913-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093913

0 1
O 1.008556 1.145541 -2.070290
O 2.134386 -2.605230 0.559171
O 0.087294 -1.447959 -1.133003
O -1.990709 -1.757446 -0.396358
O -0.577805 -0.382011 0.894385
N 1.368602 -0.876658 -0.875758
C 3.158324 0.652961 -0.870178
C 3.532734 -0.592736 0.009053
C 3.239480 1.857544 0.163255
C 3.781973 0.046387 1.444159
C 2.694044 1.167623 1.454194
C 4.729102 1.973825 0.514653
C 5.053699 0.890558 1.280370
C 1.735238 0.407649 -1.377494
C 2.316629 -1.519093 -0.025002
C -0.841559 -1.108213 -0.077667
C -3.158663 -1.526381 0.560992
C -3.930586 -0.281266 0.205918
C -3.640975 0.951312 0.846484
C -4.961124 -0.334286 -0.767647
C -4.371696 2.113390 0.515644
C -5.689849 0.827936 -1.100238
C -5.396677 2.053764 -0.457264
H 3.825335 0.815282 -1.732051
H 4.417719 -1.146268 -0.343794
H 2.732864 2.767219 -0.187826
H 3.769154 -0.691791 2.258009
H 2.783409 1.819174 2.338074
H 1.656910 0.796846 1.372616
H 5.401184 2.745484 0.130645
H 6.043091 0.603044 1.645171
H -2.740683 -1.486425 1.580990
H -3.745219 -2.445171 0.412760
H -2.836823 0.995931 1.589470
H -5.185694 -1.284333 -1.267460
H -4.141971 3.062194 1.012432
H -6.483281 0.779841 -1.853893
H -5.963214 2.956064 -0.713325


