%chk=000212817.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212817

0 1
N 0.882764 -1.172312 -0.000271
N 0.921419 1.244115 0.000482
N -1.899029 1.217554 -0.001438
N 3.047184 -0.003031 0.000465
N 2.927848 -2.362145 -0.000145
N 3.003144 2.361245 0.000698
C -1.237607 0.024621 -0.000172
C 0.260743 0.055867 -0.000104
C -1.918901 -1.210048 0.000986
C 2.273099 -1.153603 0.000244
C 2.317001 1.173245 0.000677
C -3.317055 -1.207627 0.000860
C -4.002142 0.007905 -0.000397
C -3.252171 1.198956 -0.001541
H -1.359317 -2.149385 0.001932
H -3.863671 -2.150669 0.001731
H -5.088868 0.040709 -0.000501
H -3.742034 2.180303 -0.002574
H 3.934286 -2.396354 -0.001035
H 2.406517 -3.223431 -0.001538
H 4.009733 2.371347 0.000999
H 2.499756 3.236039 0.001042


%chk=000212817-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212817

0 1
N 0.893861 -1.188218 -0.000212
N 0.920848 1.238666 0.000436
N -1.875166 1.231066 -0.000731
N 3.033313 -0.005001 -0.000297
N 2.932562 -2.344801 -0.000225
N 2.980678 2.340159 0.000570
C -1.221909 0.026110 0.000139
C 0.276680 0.039445 0.000578
C -1.910020 -1.216552 0.000692
C 2.269656 -1.144459 -0.000771
C 2.298817 1.152815 0.000095
C -3.320516 -1.217669 0.000409
C -4.004225 0.019795 -0.000454
C -3.236078 1.209357 -0.000994
H -1.323524 -2.138319 0.001350
H -3.874110 -2.162724 0.000864
H -5.097989 0.068249 -0.000710
H -3.726243 2.190339 -0.001710
H 3.949189 -2.350324 -0.000082
H 2.393820 -3.206711 -0.000119
H 3.997242 2.336644 0.000618
H 2.445814 3.205434 0.000955


