%chk=000013800.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013800

0 1
 O   -1.844600      -1.633300      0.2144000    
 N    3.731900     -0.2931000     -0.1195000    
 N  -0.4953000      -1.866300      0.4509000    
 C    4.004500      0.9210000      0.6625000    
 C    4.515100     -0.3113000      -1.363000    
 C    5.487900       1.025300       1.020600    
 C    6.015100     -0.2470000      -1.071200    
 C    6.364100      0.9725000     -0.2258000    
 C    2.303200     -0.4025000     -0.4132000    
 C    1.483500     -0.5185000      0.8742000    
 C   1.4800000E-02 -0.6559000      0.5992000    
 C  -0.9086000      0.3732000      0.4768000    
 C   -2.078400     -0.2962000      0.2322000    
 C   -3.437400      0.1003000      1.5000000E-03
 C   -3.785900       1.455300     -5.0000002E-04
 C   -4.426300     -0.8637000     -0.2227000    
 C   -5.107500       1.841700     -0.2237000    
 C   -5.747800     -0.4772000     -0.4460000    
 C   -6.088400      0.8756000     -0.4465000    
 H    3.481900      0.9169000       1.622200    
 H    3.691100       1.820400      0.1164000    
 H    4.231400      0.5248000      -2.015800    
 H    4.315700      -1.237800      -1.915000    
 H    5.762900      0.2042000       1.695100    
 H    5.674100       1.959700       1.562400    
 H    6.574400     -0.2160000      -2.013100    
 H    6.326200      -1.158100     -0.5444000    
 H    6.213600       1.883600     -0.8179000    
 H    7.421700      0.9435000      5.8300000E-02
 H    1.955000      0.4533000      -1.007800    
 H    2.123000      -1.300300      -1.019400    
 H    1.585700      0.3667000       1.510200    
 H    1.829500      -1.375600       1.466900    
 H  -0.7536000       1.439300      0.5530000    
 H   -3.044500       2.232000      0.1701000    
 H   -4.201000      -1.927300     -0.2299000    
 H   -5.373100       2.894900     -0.2241000    
 H   -6.512200      -1.229100     -0.6196000    
 H   -7.117400       1.176500     -0.6204000    


%chk=000013800-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013800

0 1
O -1.950279 -1.813985 0.307979
N 3.728653 -0.107888 -0.110727
N -0.526848 -2.071565 0.577151
C 4.098457 1.128346 0.623732
C 4.529578 -0.258121 -1.353985
C 5.593892 1.126537 1.003237
C 6.037239 -0.312801 -1.033686
C 6.477149 0.946173 -0.252716
C 2.273275 -0.223788 -0.350392
C 1.512256 -0.712412 0.913087
C 0.031335 -0.837009 0.667125
C -0.936846 0.210013 0.473365
C -2.154661 -0.424494 0.254696
C -3.519159 0.042257 -0.000391
C -3.811498 1.434248 -0.023981
C -4.569636 -0.890065 -0.227522
C -5.124707 1.882281 -0.269985
C -5.881141 -0.435897 -0.473508
C -6.165555 0.949980 -0.496054
H 3.481777 1.200228 1.538509
H 3.878154 2.039293 0.002959
H 4.338773 0.588912 -2.066709
H 4.215199 -1.191010 -1.857716
H 5.779422 0.294389 1.709431
H 5.841947 2.071685 1.523915
H 6.610338 -0.409207 -1.975935
H 6.235942 -1.214996 -0.423694
H 6.375365 1.838158 -0.905769
H 7.544134 0.874372 0.031039
H 1.828678 0.741085 -0.707098
H 2.110618 -0.965369 -1.154222
H 1.686571 -0.011954 1.751146
H 1.923433 -1.692354 1.208900
H -0.742930 1.279264 0.500598
H -3.013050 2.163557 0.152380
H -4.345447 -1.961010 -0.208867
H -5.338074 2.956630 -0.284425
H -6.682264 -1.162344 -0.647716
H -7.185789 1.300362 -0.686751


