%chk=000121321.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121321

0 1
 O   0.9595000     -0.3534000     -0.2490000    
 N    4.409400     -0.3645000     -0.2164000    
 C    2.164800     -1.0700000E-02  0.4204000    
 C    2.740300      -1.231000       1.135200    
 C    3.219000      0.3934000     -0.6086000    
 C    3.912200      -1.652900      0.2630000    
 C  -0.1788000     -0.1290000      0.5864000    
 C  -0.5981000       1.320600      0.4954000    
 C   -1.265000      -1.159500      0.3270000    
 C   -1.067900       1.873200     -0.7081000    
 C   -2.200200      -1.112600     -0.7277000    
 C   -1.227100       1.009600      -1.929300    
 C   -2.351100     -6.5000001E-03  -1.752500    
 C    5.365200     -0.5054000      -1.304500    
 C  -0.4965000       2.145000       1.628900    
 C   -1.288300      -2.271600       1.200500    
 C   -1.421700       3.230800     -0.7584000    
 C   -3.140900      -2.162400     -0.8424000    
 C  -0.8516000       3.492500       1.568200    
 C   -2.219700      -3.298800       1.060700    
 C   -1.312400       4.035800      0.3739000    
 C   -3.151200      -3.242700      3.7300002E-02
 H    2.025800      0.8121000       1.132400    
 H    2.021500      -2.045900       1.262400    
 H    3.108500     -0.9365000       2.125900    
 H    2.885700      0.1447000      -1.624700    
 H    3.416000       1.470100     -0.5712000    
 H    4.665400      -2.199900      0.8384000    
 H    3.561900      -2.288700     -0.5601000    
 H   0.1278000     -0.2951000       1.630100    
 H   -1.467000       1.642000      -2.794100    
 H  -0.2809000      0.5209000      -2.184700    
 H   -2.495600     -0.4830000      -2.732100    
 H   -3.282500      0.5291000      -1.521600    
 H    5.716200      0.4787000      -1.633700    
 H    4.940200      -1.026000      -2.170200    
 H    6.246200      -1.062800     -0.9682000    
 H  -0.1340000       1.743600       2.572400    
 H  -0.5658000      -2.347300       2.011400    
 H   -1.792300       3.669100      -1.681800    
 H   -3.885100      -2.138100      -1.637000    
 H  -0.7663000       4.116700       2.452800    
 H   -2.213600      -4.137400       1.750300    
 H   -1.589900       5.084500      0.3241000    
 H   -3.884500      -4.034600     -8.0200002E-02


%chk=000121321-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121321

0 1
O 0.960229 -0.390280 -0.240133
N 4.415380 -0.455927 -0.457765
C 2.210905 0.261696 0.224558
C 2.918039 -0.550536 1.351233
C 3.190679 0.208717 -0.976793
C 3.953001 -1.401995 0.588414
C -0.213556 -0.160791 0.660403
C -0.661490 1.297988 0.642456
C -1.260732 -1.205948 0.276652
C -1.069404 1.926214 -0.569028
C -2.164352 -1.108754 -0.824207
C -1.148976 1.113475 -1.847963
C -2.289736 0.067902 -1.798210
C 5.285671 -1.028668 -1.493173
C -0.634997 2.046121 1.843066
C -1.299387 -2.367434 1.095603
C -1.436075 3.292398 -0.541002
C -3.067783 -2.185149 -1.045977
C -1.012043 3.408434 1.863767
C -2.202054 -3.422627 0.863424
C -1.411010 4.035321 0.662780
C -3.100050 -3.327633 -0.223638
H 1.981525 1.295859 0.542998
H 2.203043 -1.161515 1.929778
H 3.436381 0.138553 2.041862
H 2.693009 -0.387208 -1.780966
H 3.431543 1.207303 -1.383548
H 4.799683 -1.732321 1.216615
H 3.461041 -2.309653 0.154388
H 0.106871 -0.393357 1.698468
H -1.334760 1.787809 -2.704737
H -0.190594 0.591818 -2.021450
H -2.413054 -0.354706 -2.814978
H -3.238441 0.598949 -1.572076
H 5.615536 -0.234158 -2.186891
H 4.784903 -1.827663 -2.098370
H 6.186842 -1.465136 -1.025926
H -0.317148 1.556056 2.772626
H -0.595612 -2.439397 1.934385
H -1.747443 3.778781 -1.473863
H -3.762894 -2.115259 -1.892869
H -0.988357 3.972926 2.802443
H -2.204985 -4.302542 1.515821
H -1.699070 5.092733 0.661588
H -3.812678 -4.134299 -0.429168


