%chk=000153653.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153653

0 1
 O   -3.889400      -1.831000      6.9999998E-04
 N  -0.4433000       2.427900     -3.0000001E-04
 N    1.457900      -1.750700     -3.0000001E-04
 C   0.5704000      0.4369000      6.0000003E-04
 C  -0.8536000      0.2373000      6.0000003E-04
 C   0.7877000       1.816300      3.0000001E-04
 C   -1.453000       1.497200     -3.9999999E-04
 C    1.700900     -0.4188000      6.0000003E-04
 C    2.996000      0.1372000      5.0000002E-04
 C    2.064600       2.387800     -9.9999997E-05
 C   -1.691900     -0.8995000      1.1000000E-03
 C   -2.841000       1.680000     -1.0000000E-03
 C    3.164600       1.527400      1.9999999E-04
 C   -3.081800     -0.7335000      3.0000001E-04
 C   -3.646100      0.5387000     -8.9999998E-04
 C    4.075100     -0.7563000       0.000000    
 C    3.845800      -2.128200     -7.9999998E-04
 C    2.533600      -2.569000     -8.9999998E-04
 C   -5.296600      -1.599700     -3.0000001E-04
 H  -0.5858000       3.428400     -7.9999998E-04
 H    2.201200       3.464300     -5.0000002E-04
 H   -1.268900      -1.900200      1.9000000E-03
 H   -3.279300       2.672600     -1.8000000E-03
 H    4.163500       1.959500       0.000000    
 H   -4.715600      0.7226000     -1.6000000E-03
 H    5.099100     -0.3903000     -9.9999997E-05
 H    4.671300      -2.831000     -1.3000000E-03
 H    2.304900      -3.629700     -1.6000000E-03
 H   -5.784600      -2.580000      1.9999999E-04
 H   -5.620000      -1.083900     -0.9108000    
 H   -5.621100      -1.082600      0.9091000    


%chk=000153653-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000153653

0 1
O -3.870298 -1.861735 -0.000211
N -0.423843 2.543008 -0.000348
N 1.432361 -1.809247 -0.000117
C 0.561937 0.467191 -0.000241
C -0.879125 0.279414 -0.000274
C 0.806544 1.875270 -0.000287
C -1.467868 1.595488 -0.000338
C 1.667561 -0.441086 -0.000207
C 3.011333 0.120319 -0.000213
C 2.119497 2.427786 -0.000280
C -1.708458 -0.862420 -0.000234
C -2.862114 1.779271 -0.000362
C 3.202209 1.548079 -0.000260
C -3.108959 -0.676792 -0.000257
C -3.684602 0.630646 -0.000309
C 4.107330 -0.796132 -0.000131
C 3.860503 -2.174265 -0.000040
C 2.506530 -2.629050 -0.000049
C -5.323411 -1.737966 -0.000314
H -0.544569 3.552953 -0.000359
H 2.277449 3.511926 -0.000326
H -1.277466 -1.865833 -0.000197
H -3.311650 2.778251 -0.000404
H 4.226268 1.940583 -0.000258
H -4.771285 0.759049 -0.000321
H 5.133950 -0.410125 -0.000104
H 4.680421 -2.899367 0.000044
H 2.286596 -3.703736 0.000012
H -5.702475 -2.771248 -0.000293
H -5.689824 -1.210305 -0.904297
H -5.689944 -1.210226 0.903575


