%chk=000030540.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030540

0 1
 O   0.1216000     -4.9000001E-03 -0.3624000    
 N    3.046500      -1.107500      0.1466000    
 N    2.970500       1.166900      0.1445000    
 C    4.368800     -0.7953000     -0.3046000    
 C    2.343800      3.8800001E-02  0.3631000    
 C    4.342300      0.7402000     -0.2709000    
 C   0.9170000     -7.9999998E-04  0.8031000    
 C   -1.243000     -4.8000002E-03 -0.1917000    
 C   -1.923700      -1.212700     -0.1027000    
 C   -1.924300       1.203400     -0.1112000    
 C   -3.308000      -1.212400      6.9499999E-02
 C   -3.308600       1.203500      6.1099999E-02
 C   -4.000300     -4.4999998E-03  0.1514000    
 C   -1.200600      -2.516300     -0.1889000    
 C   -1.201900       2.506600     -0.2070000    
 H    4.541700      -1.169800      -1.317700    
 H    5.131300      -1.200000      0.3671000    
 H    5.074200       1.128600      0.4455000    
 H    4.572900       1.157600      -1.256700    
 H   0.7077000      0.8807000       1.418500    
 H   0.7452000     -0.9041000       1.397900    
 H    2.695600      -2.051800      0.2496000    
 H   -3.860400      -2.145400      0.1437000    
 H   -3.861700       2.136500      0.1287000    
 H   -5.078000     -4.3000001E-03  0.2866000    
 H  -0.7428000      -2.760400      0.7746000    
 H  -0.4228000      -2.488000     -0.9593000    
 H   -1.879900      -3.332500     -0.4587000    
 H   -1.882600       3.321700     -0.4769000    
 H  -0.7389000       2.755300      0.7529000    
 H  -0.4283000       2.474600     -0.9814000    


%chk=000030540-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000030540

0 1
O 0.155599 0.072208 -0.400996
N 2.733937 -0.843528 -0.387622
N 3.389005 0.856611 1.036646
C 4.197641 -0.792076 -0.623609
C 2.392951 0.193789 0.483656
C 4.644926 0.202435 0.515358
C 0.942945 0.447380 0.800379
C -1.256005 0.007367 -0.188273
C -1.836805 -1.273226 0.019553
C -2.028607 1.196718 -0.261420
C -3.242865 -1.342959 0.175425
C -3.433144 1.079879 -0.105917
C -4.037357 -0.176020 0.117210
C -0.976716 -2.523210 0.042851
C -1.375730 2.543163 -0.514268
H 4.428777 -0.396369 -1.633772
H 4.663210 -1.787778 -0.521159
H 5.136407 -0.336404 1.347721
H 5.345413 0.973890 0.152822
H 0.804210 1.512661 1.056549
H 0.617487 -0.172538 1.660509
H 2.056192 -1.195690 -1.064211
H -3.713663 -2.319519 0.339524
H -4.051515 1.983475 -0.166908
H -5.124069 -0.247514 0.236745
H -0.105462 -2.415028 0.713318
H -0.574687 -2.745909 -0.963724
H -1.563228 -3.396669 0.375356
H -2.071927 3.227028 -1.029668
H -1.076521 3.034510 0.432385
H -0.467095 2.432224 -1.130161


