%chk=000031670.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031670

0 1
 N  -0.7478000     -0.2794000     -0.2749000    
 N    4.107300      0.5437000     -0.1646000    
 C   -1.870000      -1.152800      6.7699999E-02
 C   -1.079900       1.015600      0.3184000    
 C   -3.080200     -0.2592000     -0.1607000    
 C   -2.560200       1.165900      5.0000002E-04
 C   0.5257000     -0.7985000      0.2013000    
 C    1.665400      0.1303000     -0.2213000    
 C    3.039700     -0.3657000      0.2335000    
 H   -1.835000      -1.466600       1.118900    
 H   -1.904900      -2.047100     -0.5623000    
 H  -0.5180000       1.846600     -0.1186000    
 H  -0.9318000       1.019300       1.406000    
 H   -3.882500     -0.4808000      0.5504000    
 H   -3.480100     -0.3958000      -1.172300    
 H   -2.704700       1.720600     -0.9343000    
 H   -3.089000       1.702800      0.7946000    
 H   0.5287000     -0.9201000       1.292300    
 H   0.7014000      -1.789400     -0.2355000    
 H    1.662600      0.2399000      -1.314000    
 H    1.525000       1.132500      0.2010000    
 H    3.235300      -1.356400     -0.1919000    
 H    3.053100     -0.4685000       1.324100    
 H    4.123700      0.6292000      -1.180000    
 H    5.007000      0.1477000      0.1041000    


%chk=000031670-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000031670

0 1
N -0.747946 -0.231830 -0.199303
N 4.199514 0.443933 -0.250387
C -1.881091 -1.149512 0.089276
C -1.170554 1.075509 0.368267
C -3.138057 -0.298129 -0.223806
C -2.666889 1.184351 -0.028949
C 0.560820 -0.731508 0.267516
C 1.735856 0.157957 -0.183928
C 3.105596 -0.458544 0.164587
H -1.889499 -1.464766 1.166128
H -1.808120 -2.062692 -0.528658
H -0.559788 1.900604 -0.036213
H -1.063270 1.086058 1.485502
H -3.979562 -0.563626 0.439867
H -3.466119 -0.461764 -1.264454
H -2.774948 1.747455 -0.971592
H -3.248988 1.713172 0.746074
H 0.583009 -0.831136 1.387498
H 0.698334 -1.750489 -0.147229
H 1.657374 0.308162 -1.280005
H 1.681335 1.156531 0.287808
H 3.164029 -1.479996 -0.289542
H 3.173984 -0.594276 1.262053
H 4.196517 0.655839 -1.253751
H 5.129262 0.162498 0.075641


