%chk=000157778.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157778

0 1
 N   -1.912400      -2.639800      0.2904000    
 C   0.2988000      0.4821000      0.3547000    
 C   -1.562500      -1.230800      0.1171000    
 C   -2.108700       1.141500      0.7903000    
 C   -1.351800      0.6457000      -1.561000    
 C  -9.4999999E-02  -1.003500      0.5415000    
 C  -0.6454000       1.356300       1.212600    
 C   0.1096000      0.8613000      -1.132700    
 C   -2.480000     -0.3393000      0.9805000    
 C   -1.724800     -0.8341000      -1.366600    
 C   -2.269800       1.519300     -0.6910000    
 C    1.754100      0.7025000      0.7768000    
 C    2.706200     -0.1214000     -8.2800001E-02
 C    4.159600      0.1253000      0.3212000    
 C    5.122000     -0.6651000     -0.5509000    
 H   -2.765400       1.768000       1.404300    
 H   -1.472400      0.9208000      -2.614900    
 H   0.5345000      -1.664900     -6.4199999E-02
 H   4.9400002E-02  -1.299600       1.589600    
 H  -0.3836000       2.416800       1.104600    
 H  -0.5290000       1.110000       2.276000    
 H   0.7270000      0.2489000      -1.797300    
 H   0.3954000       1.907500      -1.300200    
 H   -2.388900     -0.6071000       2.041500    
 H   -3.532400     -0.4913000      0.7066000    
 H   -2.759200     -0.9974000      -1.697300    
 H   -1.088000      -1.461300      -2.004500    
 H   -3.314300       1.388400     -0.9996000    
 H   -2.025700       2.579000     -0.8360000    
 H    1.885200      0.4341000       1.832800    
 H    2.010700       1.766200      0.6891000    
 H   -2.888700      -2.787900      3.7200000E-02
 H   -1.833000      -2.898000       1.273400    
 H    2.515800      -1.193400      1.7300000E-02
 H    2.623000      0.1378000      -1.141300    
 H    4.308400     -0.1579000       1.369800    
 H    4.395300       1.192600      0.2366000    
 H    5.024100     -0.3796000      -1.603200    
 H    4.935200      -1.740500     -0.4674000    
 H    6.155000     -0.4753000     -0.2429000    


%chk=000157778-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157778

0 1
N -1.938207 -2.675396 0.285030
C 0.283009 0.480322 0.244653
C -1.632423 -1.232206 0.129970
C -2.114996 1.178989 0.832146
C -1.510276 0.659645 -1.569890
C -0.131993 -1.005196 0.455366
C -0.611417 1.375090 1.157732
C -0.006038 0.864189 -1.238333
C -2.492669 -0.310936 1.051594
C -1.886167 -0.829410 -1.346710
C -2.376036 1.560545 -0.649157
C 1.772393 0.704256 0.633246
C 2.833517 -0.090478 -0.163284
C 4.259589 0.098408 0.405325
C 5.330374 -0.690808 -0.378529
H -2.725207 1.821612 1.498047
H -1.691031 0.928673 -2.629670
H 0.460377 -1.679140 -0.191521
H 0.069671 -1.301593 1.508117
H -0.330368 2.439574 1.019314
H -0.419748 1.124967 2.221962
H 0.609745 0.243690 -1.918956
H 0.280524 1.922593 -1.409497
H -2.326970 -0.597954 2.111193
H -3.568252 -0.473318 0.830341
H -2.955487 -0.992163 -1.599406
H -1.287879 -1.489879 -2.003364
H -3.450304 1.432951 -0.892732
H -2.126139 2.627588 -0.816594
H 1.884312 0.453664 1.711009
H 2.001252 1.788283 0.544088
H -2.899548 -2.909985 0.004122
H -1.739026 -3.026373 1.231167
H 2.590305 -1.171585 -0.150759
H 2.825156 0.221272 -1.227248
H 4.268942 -0.220809 1.467979
H 4.515970 1.177786 0.403883
H 5.369924 -0.364638 -1.435061
H 5.105919 -1.774416 -0.371774
H 6.337503 -0.551910 0.056299


