%chk=000203007.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203007

0 1
O -1.411901 2.390349 -1.985193
N -1.148211 -0.005393 -0.657384
N 2.432183 -0.072081 1.689732
N -2.203003 0.840683 -0.382717
N -3.360925 2.859790 -0.859820
C 0.108542 -2.078601 -0.477402
C -0.434381 -3.523130 -0.356289
C -1.648465 -3.461203 0.590701
C -2.154439 -2.005132 0.570867
C -1.118341 -1.215264 -0.194410
C 1.229960 -1.825837 0.542653
C 1.850995 -0.454157 0.512245
C 1.879122 0.368370 -0.629378
C 2.506531 1.613477 -0.550358
C 3.046531 1.136605 1.744707
C 3.107728 2.010398 0.647849
C -2.225121 2.051581 -1.155266
H 0.489717 -1.888851 -1.508858
H 0.330883 -4.224737 0.012608
H -0.737653 -3.895213 -1.351223
H -1.356833 -3.754976 1.614673
H -2.436147 -4.165286 0.276424
H -2.269380 -1.608256 1.597011
H -3.146264 -1.937926 0.088620
H 2.042158 -2.571022 0.387049
H 0.848586 -2.030227 1.570459
H 1.382196 0.064109 -1.550393
H -3.090387 0.465540 -0.027027
H 2.518756 2.272335 -1.419245
H 3.497569 1.399154 2.707751
H 3.603551 2.972051 0.732429
H -3.324651 3.798061 -1.248150
H -3.776608 2.834589 0.059034


%chk=000203007-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000203007

0 1
O -1.634994 2.820610 -1.257636
N -1.314292 0.095143 -0.711376
N 3.245578 -0.568265 1.285473
N -2.561144 0.707104 -0.739985
N -3.950744 2.542433 -1.167044
C 0.118790 -1.871241 -0.257295
C -0.317781 -3.364919 -0.188707
C -1.632232 -3.351856 0.638600
C -2.366902 -2.077647 0.138664
C -1.233510 -1.149514 -0.312749
C 0.988769 -1.455643 0.980239
C 2.003819 -0.341009 0.742664
C 1.698061 0.854616 0.038380
C 2.700619 1.838945 -0.103823
C 4.200320 0.396749 1.139358
C 3.979541 1.613139 0.455599
C -2.635392 2.080014 -1.074487
H 0.702506 -1.665366 -1.172107
H 0.460562 -4.010765 0.252675
H -0.527286 -3.740793 -1.209387
H -1.402699 -3.257470 1.716095
H -2.234327 -4.266825 0.504372
H -3.007079 -1.619734 0.920031
H -3.025682 -2.320435 -0.722605
H 1.570473 -2.328984 1.325831
H 0.325702 -1.164930 1.820530
H 0.698423 1.007998 -0.382098
H -3.410249 0.191467 -0.475248
H 2.477987 2.767885 -0.639983
H 5.175419 0.172646 1.588987
H 4.782345 2.352542 0.367181
H -4.069917 3.531665 -1.369488
H -4.772387 1.942238 -1.138962


