%chk=000027285.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027285

0 1
 O  -0.4242000      -3.205500      0.5282000    
 N   -2.148200       1.070500     -0.1352000    
 N    2.489300      0.3730000     -0.1054000    
 N   0.1752000      0.7527000     -0.1251000    
 N    1.054600      -1.453500      0.2174000    
 N   -1.318200      -1.096700      0.2024000    
 C   -1.956800       2.495800     -0.3708000    
 C   -3.512800      0.5671000     -4.3000001E-02
 C    2.712800       1.785200     -0.3385000    
 C    3.628900     -0.5110000      3.1700000E-02
 C   -1.056700      0.2104000     -1.4700000E-02
 C    1.175800     -0.1339000      6.0000003E-04
 C   -1.655400       3.235400      0.9164000    
 C   -3.975000     -2.7100001E-02  -1.357500    
 C    2.784600       2.557800      0.9624000    
 C    4.021500      -1.120300      -1.298300    
 C  -0.2209000      -1.863500      0.3071000    
 C   -1.774400      -3.636400      0.6223000    
 H   -1.159400       2.670000      -1.103700    
 H   -2.860600       2.926500     -0.8200000    
 H   -3.606300     -0.1728000      0.7615000    
 H   -4.194200       1.381500      0.2336000    
 H    3.660400       1.923500     -0.8748000    
 H    1.949000       2.218000     -0.9959000    
 H    4.487300      5.3100001E-02  0.4185000    
 H    3.449800      -1.298700      0.7735000    
 H   -2.464900       3.104500       1.642300    
 H  -0.7315000       2.880500       1.383000    
 H   -1.544100       4.306700      0.7218000    
 H   -3.921200      0.7127000      -2.163300    
 H   -3.362900     -0.8851000      -1.652900    
 H   -5.012500     -0.3663000      -1.276900    
 H    1.849100       2.480600       1.525600    
 H    3.589400       2.181600       1.602600    
 H    2.975000       3.617600      0.7659000    
 H    3.212800      -1.731100      -1.712300    
 H    4.262500     -0.3451000      -2.033300    
 H    4.901700      -1.759900      -1.179100    
 H   -1.772300      -4.716400      0.7969000    
 H   -2.314200      -3.447900     -0.3120000    
 H   -2.282000      -3.160100       1.468000    


%chk=000027285-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000027285

0 1
O -0.362298 -3.254233 0.528154
N -2.144978 1.057711 -0.139262
N 2.513689 0.346088 -0.099435
N 0.191938 0.759545 -0.110589
N 1.082501 -1.496878 0.206259
N -1.323412 -1.129915 0.192061
C -1.949951 2.501155 -0.394448
C -3.526140 0.545972 -0.007724
C 2.764097 1.780544 -0.353221
C 3.674303 -0.561265 0.048959
C -1.063370 0.215337 -0.020365
C 1.230803 -0.138541 -0.001834
C -1.817090 3.325355 0.904622
C -4.142277 0.134251 -1.362504
C 2.846559 2.611493 0.945814
C 4.137069 -1.159057 -1.296810
C -0.208094 -1.898089 0.301618
C -1.746215 -3.755860 0.638702
H -1.038329 2.622395 -1.002218
H -2.813049 2.855363 -0.989782
H -3.504503 -0.324313 0.667892
H -4.134063 1.339347 0.468041
H 3.710003 1.858646 -0.922103
H 1.948209 2.166893 -0.986216
H 4.492347 0.016497 0.520542
H 3.384166 -1.376821 0.730674
H -2.701128 3.197604 1.556143
H -0.920854 3.005000 1.463263
H -1.716591 4.401488 0.670040
H -4.150179 0.978269 -2.076566
H -3.560783 -0.692308 -1.805424
H -5.185366 -0.206351 -1.224250
H 1.879799 2.574771 1.476528
H 3.632085 2.225484 1.621048
H 3.080024 3.667670 0.715006
H 3.335831 -1.787038 -1.721859
H 4.392261 -0.368191 -2.026549
H 5.032209 -1.791206 -1.148448
H -1.627844 -4.836556 0.806816
H -2.310671 -3.558026 -0.288560
H -2.269705 -3.278832 1.484983


