%chk=000228632.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228632

0 1
O -2.333492 2.704023 0.012158
O -4.388185 -1.433641 0.036769
N 2.582341 0.143179 -0.197446
N 0.361277 1.177126 -0.067944
N 0.395991 -1.123676 -0.074358
N -2.088202 -1.440389 -0.022821
N -3.360586 0.641602 0.029625
C 3.174736 -0.991892 -0.988990
C 3.239033 0.301691 1.148824
C 4.670348 -0.720815 -1.206338
C 4.735882 0.581045 0.945238
C 5.400730 -0.534830 0.129387
C 1.161615 0.036488 -0.084059
C -0.974992 0.737436 -0.024760
C -0.917039 -0.685549 -0.043449
C -2.200573 1.494812 0.006944
C 0.777289 2.580415 -0.040839
C -3.358487 -0.785400 0.015783
C -2.022633 -2.921619 -0.041182
C -4.706467 1.278372 0.063212
H 2.643427 -1.041574 -1.965103
H 3.021937 -1.973965 -0.488747
H 3.098263 -0.600008 1.785108
H 2.759286 1.153790 1.675427
H 4.797816 0.185563 -1.831958
H 5.114958 -1.557084 -1.777687
H 5.227913 0.686230 1.930151
H 4.866678 1.551216 0.424988
H 5.394314 -1.482066 0.702205
H 6.464971 -0.292376 -0.049473
H 1.644917 2.737335 -0.709844
H -0.058140 3.236048 -0.372852
H 1.058511 2.893580 0.980879
H -3.043673 -3.348332 -0.013239
H -1.455700 -3.288995 0.832640
H -1.513266 -3.269333 -0.957456
H -4.601421 2.379797 0.073960
H -5.258617 0.961987 0.964905
H -5.293761 0.983511 -0.823456


%chk=000228632-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000228632

0 1
O -2.287144 2.740022 0.356518
O -4.469351 -1.401148 -0.252309
N 2.516969 -0.090866 -0.014892
N 0.377657 1.101610 0.169805
N 0.333785 -1.174984 -0.148854
N -2.121522 -1.415902 -0.226993
N -3.354676 0.639550 0.050369
C 3.148327 -1.308166 -0.591760
C 3.303305 0.511004 1.100043
C 4.565695 -0.975264 -1.100960
C 4.721216 0.882252 0.624253
C 5.432844 -0.348356 0.016185
C 1.129488 -0.068481 0.024935
C -0.978954 0.711312 0.105875
C -0.954914 -0.675887 -0.105284
C -2.185963 1.480039 0.191145
C 0.861236 2.489899 0.181056
C -3.378411 -0.767262 -0.149478
C -2.064972 -2.875331 -0.429224
C -4.681354 1.292569 0.119644
H 2.504460 -1.676932 -1.405635
H 3.195208 -2.112130 0.176946
H 3.373671 -0.224598 1.935121
H 2.779023 1.397733 1.488833
H 4.485142 -0.267599 -1.948783
H 5.034880 -1.901346 -1.484036
H 5.297042 1.281955 1.480485
H 4.649746 1.685113 -0.135290
H 5.607506 -1.101532 0.812321
H 6.425175 -0.063044 -0.379563
H 1.756243 2.565285 -0.460626
H 0.058827 3.140031 -0.198577
H 1.111509 2.829352 1.202611
H -3.100200 -3.243820 -0.472391
H -1.522428 -3.351651 0.404581
H -1.538364 -3.108855 -1.370021
H -4.507203 2.365830 0.285518
H -5.272135 0.862452 0.944943
H -5.234367 1.130852 -0.820307


