%chk=000027262.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027262

0 1
 O  -0.8082000      0.2101000       1.699300    
 N   0.8044000      -1.621100      0.4040000    
 N  -0.5032000      -1.369300      2.7000001E-02
 N   -5.239900      0.1453000     -0.5400000    
 C    2.242800       1.050700     -4.3299999E-02
 C    1.705100      -1.360700     -0.7229000    
 C    3.168100      -1.752200     -0.4105000    
 C    1.628700      0.1266000      -1.108100    
 C    3.684300      0.6330000      0.2748000    
 C    3.784100     -0.8416000      0.6633000    
 C    2.195400       2.506900     -0.5046000    
 C    3.321200      -3.224300     -2.0000000E-02
 C   0.7657000       2.911200     -0.8545000    
 C    2.767700       3.427800      0.5700000    
 C   -1.229600     -0.4322000      0.7406000    
 C   -2.631900     -0.2292000      0.2922000    
 C   -3.565500      0.2042000       1.203200    
 C   -2.954900     -0.4824000      -1.019700    
 C   -4.858700      0.3765000      0.7364000    
 C   -4.275400     -0.2791000      -1.387100    
 H    1.657000      0.9582000      0.8803000    
 H    1.377400      -1.959300      -1.584500    
 H    3.745700      -1.610400      -1.335300    
 H   0.5942000      0.3969000      -1.337400    
 H    2.177900      0.2609000      -2.050900    
 H    4.089100       1.214300       1.109600    
 H    4.330400      0.8209000     -0.5922000    
 H    4.839600      -1.101300      0.8095000    
 H    3.285800     -0.9994000       1.628000    
 H    2.805900       2.632000      -1.408800    
 H    2.850100      -3.875800     -0.7633000    
 H    4.381300      -3.495000      3.5399999E-02
 H    2.877800      -3.438800      0.9576000    
 H   0.8452000      -2.606300      0.6596000    
 H   6.3199997E-02   2.646500     -5.7000000E-02
 H   0.6978000       3.994700      -1.006200    
 H   0.4259000       2.454600      -1.788800    
 H    2.297100       3.252600       1.543400    
 H    2.600700       4.478500      0.3066000    
 H    3.849700       3.308900      0.6786000    
 H  -0.8946000      -1.945500     -0.7109000    
 H   -3.329100      0.4034000       2.241900    
 H   -2.243300     -0.7951000      -1.773800    
 H   -5.648100      0.7149000       1.399500    
 H   -4.601000     -0.4511000      -2.407800    


%chk=000027262-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000027262

0 1
O -0.801986 0.334769 1.652539
N 0.852163 -1.602485 0.355161
N -0.517192 -1.404285 0.095450
N -5.421218 0.036103 -0.512847
C 2.306199 1.077994 -0.070612
C 1.765010 -1.347329 -0.794561
C 3.206016 -1.796407 -0.419486
C 1.734579 0.151704 -1.176847
C 3.741780 0.611909 0.290360
C 3.789666 -0.882612 0.685766
C 2.255267 2.581016 -0.492987
C 3.307174 -3.295488 -0.052256
C 0.811605 3.041877 -0.824767
C 2.842078 3.508593 0.601855
C -1.253286 -0.407390 0.735198
C -2.688414 -0.291671 0.259998
C -3.652277 0.200282 1.173832
C -3.117258 -0.596379 -1.057360
C -4.991651 0.338534 0.751439
C -4.479455 -0.415680 -1.392418
H 1.666075 0.955577 0.827832
H 1.440769 -1.944575 -1.687080
H 3.804055 -1.635299 -1.341945
H 0.693571 0.435481 -1.416108
H 2.324594 0.278224 -2.109669
H 4.138738 1.214220 1.128003
H 4.412748 0.789296 -0.579036
H 4.834077 -1.186944 0.898553
H 3.210372 -1.027754 1.618693
H 2.876501 2.699648 -1.409723
H 2.798703 -3.936041 -0.798760
H 4.365813 -3.610047 -0.007559
H 2.874649 -3.512248 0.944308
H 1.016766 -2.491765 0.842063
H 0.133232 2.828308 0.023631
H 0.786309 4.130985 -1.016607
H 0.403205 2.542021 -1.721489
H 2.307183 3.363563 1.560417
H 2.730792 4.570031 0.310890
H 3.916497 3.325009 0.778946
H -0.988154 -1.992693 -0.606329
H -3.341430 0.474831 2.186076
H -2.417825 -0.928881 -1.832698
H -5.761236 0.707528 1.438232
H -4.838907 -0.632030 -2.404898


