%chk=000036767.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036767

0 1
 O  -0.1757000      -1.563900     -0.1782000    
 N    3.044700      0.2196000     -0.4911000    
 C   0.7313000     -0.5353000     -0.6560000    
 C   0.1449000      0.8420000     -0.3088000    
 C    2.100700     -0.7591000     -3.5900000E-02
 C   -1.277700      0.4616000     -0.1623000    
 C   -1.380500     -0.9179000     -6.9100000E-02
 C    4.372400      7.3000002E-03  9.0099998E-02
 C   -2.397800       1.265400     -5.5399999E-02
 C   -2.592000      -1.548900      0.1363000    
 C   -3.636300      0.6483000      0.1392000    
 C   -3.732500     -0.7499000      0.2361000    
 C    4.312300      0.1401000       1.609300    
 C    5.355000       1.008600     -0.5089000    
 C   -4.868600       1.482100      0.2547000    
 H   0.7925000     -0.6519000      -1.747900    
 H   0.3168000       1.569300      -1.107200    
 H   0.5194000       1.234000      0.6429000    
 H    2.435600      -1.772900     -0.2906000    
 H    1.967200     -0.7488000       1.051800    
 H    2.723200       1.161200     -0.2702000    
 H    4.730800     -0.9973000     -0.1677000    
 H   -2.309300       2.345500     -0.1138000    
 H   -2.661700      -2.627900      0.2150000    
 H    3.810400     -0.7089000       2.083500    
 H    3.807100       1.062300       1.918700    
 H    5.325100      0.1693000       2.027900    
 H    5.070500       2.040900     -0.2755000    
 H    6.364600      0.8422000     -0.1180000    
 H    5.401300      0.9085000      -1.599100    
 H   -4.698100      -1.223800      0.3950000    
 H   -4.765500       2.420900     -0.3002000    
 H   -5.737600      0.9594000     -0.1594000    
 H   -5.066200       1.716400       1.305400    


%chk=000036767-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000036767

0 1
O -0.201039 -1.484909 -0.152818
N 3.102748 0.327655 -0.237470
C 0.774135 -0.402370 -0.566221
C 0.037750 0.954228 -0.328183
C 2.063284 -0.609772 0.237129
C -1.419164 0.529534 -0.191131
C -1.467933 -0.878413 -0.070046
C 4.511729 -0.012774 0.098023
C -2.606396 1.277272 -0.130751
C -2.676184 -1.569615 0.114946
C -3.854316 0.616006 0.052809
C -3.864175 -0.799293 0.172633
C 4.805958 -0.064774 1.623189
C 5.444194 0.986951 -0.615288
C -5.147776 1.410201 0.144628
H 0.979523 -0.556245 -1.641610
H 0.211285 1.656502 -1.161353
H 0.393016 1.440138 0.603975
H 2.422193 -1.640983 0.061306
H 1.822043 -0.529003 1.323881
H 2.889303 1.303116 0.017482
H 4.695729 -1.022174 -0.323578
H -2.580480 2.370074 -0.224404
H -2.694655 -2.659742 0.201356
H 4.132776 -0.773621 2.138991
H 4.669693 0.934978 2.079971
H 5.846678 -0.387283 1.814162
H 5.281137 2.015394 -0.235971
H 6.504926 0.730994 -0.442411
H 5.249523 0.985600 -1.701506
H -4.822953 -1.314598 0.308947
H -5.087108 2.352496 -0.428826
H -6.005592 0.833138 -0.244418
H -5.383551 1.679691 1.193156


