%chk=000273063.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273063

0 1
O 0.149167 -3.119850 0.184699
N -1.149903 -0.522135 0.176117
N 2.205884 -1.940957 -0.090804
C -1.897738 0.772106 0.182142
C -2.948717 0.768334 -0.949411
C -2.696637 0.902486 1.497321
C -4.271251 0.294876 -0.322947
C -4.112499 0.375944 1.208085
C 0.150526 -0.656366 0.049983
C 1.235438 0.234722 -0.110037
C 0.863134 -2.164681 0.059236
C 2.440664 -0.584913 -0.188949
C 1.342060 1.638319 -0.197637
C 3.705098 0.043777 -0.353062
C 2.579213 2.221630 -0.356452
C 3.754854 1.415846 -0.433104
H -1.168862 1.616034 0.060752
H -2.649177 0.136872 -1.803928
H -3.054673 1.790530 -1.358253
H -2.730608 1.964351 1.804823
H -2.221642 0.365652 2.336859
H -4.508736 -0.736890 -0.636930
H -5.114592 0.917575 -0.668687
H -4.876146 1.037526 1.652635
H -4.265848 -0.615522 1.669659
H -1.728032 -1.369582 0.281764
H 0.432531 2.241299 -0.137230
H 4.596482 -0.579648 -0.410495
H 2.682967 3.300330 -0.426000
H 4.715645 1.920333 -0.559249


%chk=000273063-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000273063

0 1
O -0.184026 -2.981782 -0.718941
N -1.273548 -0.404094 -0.556819
N 1.986530 -1.980400 -0.346736
C -2.066536 0.848854 -0.499673
C -3.509294 0.578097 -0.985340
C -2.276488 1.323620 0.967389
C -4.230329 -0.056801 0.241468
C -3.460567 0.463284 1.504345
C 0.039190 -0.545319 -0.400440
C 1.150443 0.297339 -0.162462
C 0.621060 -2.019643 -0.509716
C 2.294829 -0.636630 -0.147444
C 1.331344 1.699082 0.035623
C 3.597186 -0.100707 0.063707
C 2.626551 2.189248 0.239143
C 3.742701 1.283646 0.249969
H -1.542205 1.604524 -1.113235
H -3.544455 -0.053391 -1.891528
H -3.971820 1.547528 -1.244380
H -2.548941 2.395486 0.943163
H -1.361154 1.225739 1.575702
H -4.189487 -1.160561 0.192733
H -5.298768 0.217722 0.261427
H -4.112216 1.059413 2.165940
H -3.083033 -0.384383 2.102492
H -1.758713 -1.306248 -0.724859
H 0.477183 2.386168 0.033577
H 4.458458 -0.774639 0.077637
H 2.797968 3.258852 0.394583
H 4.746742 1.693996 0.413574


