%chk=000234970.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234970

0 1
O -2.886087 0.728232 -0.910528
N -0.864578 0.189315 -0.019230
N 0.874075 1.670008 0.221331
N 0.456809 -1.915470 -0.312842
N 3.858422 0.591932 0.116531
N 2.871994 -1.527582 -0.209608
C -2.241588 -0.325444 -0.153731
C -2.911512 -0.507998 1.217081
C -4.408079 -0.779007 1.029493
C -5.049598 0.328754 0.184875
C -4.295846 0.499816 -1.134668
C 0.311732 -0.563005 -0.122407
C 1.392639 0.373527 0.039984
C -0.456059 1.549643 0.178778
C 2.723319 -0.157419 -0.013670
C 1.759944 -2.308442 -0.345077
C 3.790916 2.053492 0.321487
C 5.189978 -0.050677 0.047682
H -2.237264 -1.264392 -0.763313
H -2.764671 0.395801 1.841272
H -2.424433 -1.338483 1.764916
H -4.904874 -0.841973 2.016703
H -4.561798 -1.765778 0.550201
H -6.114164 0.102441 -0.010476
H -5.035880 1.283214 0.748391
H -4.406104 -0.376253 -1.797611
H -4.582097 1.420803 -1.675801
H -1.188111 2.342904 0.258217
H 1.948249 -3.384782 -0.498238
H 3.229315 2.294464 1.245848
H 3.251672 2.542588 -0.514362
H 4.796028 2.492152 0.395745
H 5.295421 -0.807673 0.848663
H 5.994947 0.690483 0.148798
H 5.312785 -0.584192 -0.915035


%chk=000234970-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000234970

0 1
O -2.900174 0.704681 -0.992026
N -0.856999 0.302337 0.083681
N 0.895990 1.734119 0.407179
N 0.372116 -1.785182 -0.411947
N 3.888154 0.562068 0.136286
N 2.804378 -1.465306 -0.341518
C -2.221922 -0.199362 -0.046448
C -2.975747 -0.252355 1.299717
C -4.435516 -0.711289 1.066325
C -5.123902 0.195060 0.018161
C -4.279942 0.246378 -1.268420
C 0.304257 -0.457525 -0.105136
C 1.389168 0.441622 0.106284
C -0.441196 1.605411 0.383471
C 2.708137 -0.119180 -0.025175
C 1.669821 -2.200751 -0.512573
C 3.955344 2.000071 0.451864
C 5.162435 -0.164180 -0.038161
H -2.140797 -1.219344 -0.480154
H -2.963853 0.755893 1.756949
H -2.445552 -0.941430 1.982718
H -4.993775 -0.701018 2.019935
H -4.437219 -1.760235 0.704723
H -6.137225 -0.180526 -0.221937
H -5.233440 1.219965 0.421781
H -4.240965 -0.758513 -1.744325
H -4.671693 0.973182 -1.998273
H -1.148523 2.415269 0.537111
H 1.821025 -3.255659 -0.762261
H 4.505740 2.158234 1.399527
H 2.940249 2.413102 0.553134
H 4.486764 2.544607 -0.352878
H 5.222314 -1.026169 0.648273
H 5.989427 0.534453 0.169273
H 5.258623 -0.557427 -1.065760


