%chk=000093286.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093286

0 1
 O   -1.076600     -0.1369000      0.5979000    
 O    4.315000      0.1808000     -0.5159000    
 N   -4.293400     -0.4782000      -1.171200    
 C   -3.403100     -0.2945000     -2.6300000E-02
 C   -1.954000     -0.2704000     -0.5137000    
 C   0.2628000     -5.7799999E-02  0.3209000    
 C    1.025200      -1.220600      0.2572000    
 C   0.8524000       1.184500      0.1062000    
 C   -3.771200      0.9853000      0.7250000    
 C    2.389100      -1.140000     -2.3800001E-02
 C    2.216300       1.265000     -0.1749000    
 C    2.984600      0.1027000     -0.2400000    
 C   0.4059000      -2.560000      0.4855000    
 C   4.6799999E-02   2.440100      0.1731000    
 H   -3.531900      -1.138800      0.6613000    
 H   -1.727700      -1.201600      -1.047600    
 H   -1.800100      0.5625000      -1.211500    
 H   -4.816800      0.9609000       1.051800    
 H   -3.634000       1.872600      9.6600004E-02
 H   -3.152200       1.107900       1.620000    
 H    2.995400      -2.041100     -7.8699999E-02
 H    2.682100       2.232600     -0.3459000    
 H  -0.3242000      -2.526700       1.301000    
 H  -8.9299999E-02  -2.909300     -0.4258000    
 H    1.158600      -3.303800      0.7696000    
 H  -0.5109000       2.584000     -0.7573000    
 H  -0.6555000       2.415000       1.013000    
 H   0.6852000       3.317400      0.3246000    
 H   -4.200400      0.3098000      -1.811400    
 H   -5.262900     -0.4710000     -0.8562000    
 H    4.558000       1.114800     -0.6373000    


%chk=000093286-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093286

0 1
O -1.097074 -0.049101 0.615627
O 4.429585 0.068422 -0.494703
N -4.326374 -0.530549 -1.188431
C -3.447814 -0.277130 -0.021266
C -2.001901 -0.212227 -0.546418
C 0.288693 -0.005790 0.284114
C 1.030287 -1.220138 0.237865
C 0.908007 1.257037 0.084704
C -3.816457 0.979993 0.803435
C 2.417104 -1.154956 -0.025460
C 2.299577 1.291665 -0.175490
C 3.042955 0.091372 -0.237578
C 0.348575 -2.554095 0.478321
C 0.100181 2.539596 0.158081
H -3.514212 -1.165075 0.636460
H -1.764910 -1.145061 -1.092372
H -1.874595 0.647711 -1.240630
H -4.843905 0.896755 1.203322
H -3.766126 1.886865 0.168413
H -3.116310 1.112075 1.646958
H 3.024360 -2.064878 -0.061842
H 2.795615 2.260720 -0.323938
H -0.493099 -2.439625 1.181939
H -0.063077 -2.971752 -0.461434
H 1.059079 -3.294434 0.884015
H -0.374140 2.774386 -0.815212
H -0.709393 2.447459 0.901153
H 0.739250 3.398007 0.428513
H -4.450600 0.290815 -1.791442
H -5.225095 -0.959303 -0.948191
H 4.775016 0.986434 -0.622310


