%chk=000055161.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055161

0 1
 O   -2.873900       1.165300       1.266300    
 N   0.1501000       1.999500     -0.7190000    
 C    1.431900       1.323600     -0.8629000    
 C  -0.9815000       1.314200     -0.3757000    
 C    1.810200      0.5897000      0.4228000    
 C   -1.900900       1.993500      0.6111000    
 C   -1.301700      0.1118000     -0.8737000    
 C   -2.542800     -0.5191000     -0.4484000    
 C    3.111400     -0.1669000      0.3119000    
 C   0.1850000       3.455400     -0.7137000    
 C   -3.273800      3.9200000E-02  0.6027000    
 C   -2.998000      -1.695300      -1.054800    
 C    3.097000      -1.484200     -0.1194000    
 C    4.297800      0.4688000      0.6429000    
 C   -4.442900     -0.5768000       1.054300    
 C   -4.174100      -2.303100     -0.6121000    
 C   -4.894900      -1.745100      0.4424000    
 C    4.299500      -2.183500     -0.2221000    
 C    5.500400     -0.2305000      0.5400000    
 C    5.501100      -1.556700      0.1074000    
 H    2.225100       2.039000      -1.116700    
 H    1.393300      0.6254000      -1.708600    
 H    1.877400       1.308200       1.251400    
 H    1.029900     -0.1180000      0.7291000    
 H   -1.310300       2.439900       1.419500    
 H   -2.451700       2.803200      0.1179000    
 H  -0.6841000     -0.4045000      -1.599900    
 H   0.4070000       3.831800      0.2903000    
 H  -0.7635000       3.884700      -1.054500    
 H   0.9550000       3.833900      -1.395400    
 H   -2.443900      -2.150700      -1.872200    
 H    2.166400      -1.979800     -0.3808000    
 H    4.307300       1.501800      0.9787000    
 H   -5.006500     -0.1513000       1.880300    
 H   -4.524600      -3.215200      -1.086400    
 H   -5.806600      -2.222400      0.7897000    
 H    4.300200      -3.215800     -0.5597000    
 H    6.436200      0.2576000      0.7961000    
 H    6.437400      -2.101000      2.7000001E-02


%chk=000055161-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000055161

0 1
O -3.362722 1.477027 0.732613
N 0.163438 2.051719 -0.389610
C 1.402785 1.295775 -0.633692
C -1.046505 1.363079 -0.233289
C 2.035291 0.685644 0.659716
C -2.296040 2.205362 0.025368
C -1.216740 0.001112 -0.396535
C -2.540633 -0.606186 -0.276790
C 3.277561 -0.125520 0.334767
C 0.307611 3.463734 0.007824
C -3.604966 0.154481 0.290048
C -2.818043 -1.953843 -0.631973
C 3.178965 -1.505993 0.018470
C 4.556405 0.488312 0.284372
C -4.878783 -0.393047 0.519343
C -4.096591 -2.516211 -0.423283
C -5.127789 -1.738768 0.156758
C 4.324442 -2.252759 -0.337328
C 5.705206 -0.254158 -0.070412
C 5.592774 -1.628578 -0.384408
H 2.138924 1.968029 -1.112740
H 1.197779 0.485814 -1.357841
H 2.283030 1.511838 1.353173
H 1.274311 0.055362 1.154822
H -2.094167 3.066050 0.681679
H -2.698086 2.584841 -0.941449
H -0.377011 -0.661190 -0.625847
H 0.268027 3.615873 1.107463
H -0.464978 4.099959 -0.459178
H 1.286007 3.828264 -0.347374
H -2.016334 -2.561677 -1.069908
H 2.200261 -2.000833 0.065476
H 4.653273 1.552459 0.535988
H -5.653159 0.230386 0.977405
H -4.288223 -3.556727 -0.707499
H -6.119755 -2.171772 0.325172
H 4.230082 -3.319250 -0.571505
H 6.685634 0.235045 -0.097280
H 6.482622 -2.207052 -0.656717


