%chk=000004980.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004980

0 1
 O   7.3299997E-02   2.147500      0.4386000    
 N   -3.709600     -7.7000000E-02 -7.9400003E-02
 N    1.755700      -2.166300     -4.4799998E-02
 C   -1.441300     -0.6171000      0.7946000    
 C  -5.3700000E-02 -0.9731000      0.4345000    
 C    1.015900     -7.2600000E-02  0.1703000    
 C   -2.348700     -0.4580000     -0.4417000    
 C    2.139300     -0.8467000     -0.1275000    
 C   0.4319000      -2.252700      0.2940000    
 C    1.136400       1.331200      0.1558000    
 C    3.382400     -0.2850000     -0.4401000    
 C    2.373500       1.907100     -0.1550000    
 C   -4.528300      0.1091000      -1.278400    
 C   -3.704800       1.144300      0.7274000    
 C    3.478000       1.109600     -0.4482000    
 H   -1.858800      -1.412700       1.428200    
 H   -1.417300      0.2671000       1.436100    
 H   -2.372100      -1.414000     -0.9817000    
 H   -1.908400      0.2765000      -1.129800    
 H  -4.3800000E-02  -3.217500      0.4037000    
 H    2.363700      -2.956300     -0.2107000    
 H    4.242700     -0.9051000     -0.6684000    
 H    2.479300       2.989200     -0.1695000    
 H   -4.552900     -0.8104000      -1.874100    
 H   -4.155400      0.9216000      -1.912700    
 H   -5.565900      0.3321000      -1.005900    
 H   -4.729000       1.514500      0.8608000    
 H   -3.121900       1.950400      0.2677000    
 H   -3.342200      0.9622000       1.743300    
 H    4.429400       1.577900     -0.6871000    
 H  -0.7471000       1.687800      0.2074000    


%chk=000004980-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000004980

0 1
O 0.153039 2.216813 0.293258
N -3.731492 -0.005240 -0.101672
N 1.844350 -2.237250 0.018969
C -1.461443 -0.660753 0.809914
C -0.030318 -1.000173 0.456570
C 1.068381 -0.095889 0.131574
C -2.302820 -0.220381 -0.419574
C 2.232483 -0.901209 -0.134042
C 0.489595 -2.291808 0.374311
C 1.212883 1.320879 0.050905
C 3.495043 -0.356588 -0.462968
C 2.461965 1.881258 -0.272216
C -4.556799 0.082938 -1.325722
C -3.963705 1.145898 0.794559
C 3.587111 1.048211 -0.523720
H -1.962295 -1.544328 1.246126
H -1.486244 0.119882 1.597668
H -2.238019 -1.022669 -1.177574
H -1.845912 0.691499 -0.898369
H -0.010761 -3.242019 0.552598
H 2.458164 -3.040354 -0.094019
H 4.365199 -0.991644 -0.658638
H 2.546995 2.970469 -0.327702
H -4.418788 -0.828732 -1.933684
H -4.309032 0.967518 -1.966112
H -5.624189 0.151062 -1.049340
H -5.046249 1.251479 0.985124
H -3.594331 2.115371 0.366926
H -3.471337 0.987551 1.768847
H 4.545386 1.516993 -0.772892
H -0.706562 1.734817 0.378295


