%chk=000197018.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000197018

0 1
O 1.781485 -1.325589 1.848633
O -1.415250 2.812605 0.029339
O -3.599734 1.909896 0.205739
N 0.417194 -3.118014 0.000264
C 0.714739 -1.695864 -0.381158
C -0.488515 -0.794568 -0.164556
C 1.938850 -1.186186 0.438557
C -1.781039 -1.311949 -0.052587
C -0.237841 0.616608 -0.131974
C -0.853132 -3.575809 -0.649659
C -2.016975 -2.794187 -0.025935
C 2.207867 0.270104 0.107158
C 1.135246 1.139162 -0.181753
C -1.355926 1.421488 -0.014942
C -2.916936 -0.466266 0.079073
C -2.672629 0.883583 0.089582
C 1.541760 -4.027684 -0.370385
C 3.519486 0.753213 0.108213
C 1.401724 2.481729 -0.492945
C -2.829890 3.156245 0.186770
C 3.775182 2.093686 -0.198684
C 2.716746 2.953707 -0.504011
H 0.989080 -1.607233 -1.472525
H 2.838547 -1.818557 0.238811
H -0.982123 -4.661087 -0.445798
H -0.852550 -3.451677 -1.753842
H -2.143540 -3.107237 1.036570
H -2.961844 -3.059348 -0.539889
H -3.920080 -0.871613 0.169296
H 2.433434 -3.749684 0.220186
H 1.808906 -4.031873 -1.436452
H 1.283666 -5.056417 -0.069383
H 4.345064 0.087589 0.358682
H 0.578492 3.163135 -0.722165
H 0.848017 -1.165895 2.112487
H -3.137782 3.728810 -0.697704
H -2.953611 3.643748 1.162917
H 4.798137 2.465578 -0.196487
H 2.914577 3.996751 -0.746246


%chk=000197018-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000197018

0 1
O 1.646515 -1.325371 1.866546
O -1.471742 2.886246 -0.146626
O -3.667825 1.967765 0.036938
N 0.441191 -3.094111 0.027015
C 0.722586 -1.686181 -0.386821
C -0.497465 -0.773283 -0.200759
C 1.924472 -1.152379 0.430677
C -1.803336 -1.301826 -0.066285
C -0.257228 0.648880 -0.204229
C -0.838099 -3.584540 -0.553221
C -2.020454 -2.803217 0.027713
C 2.199861 0.302687 0.108651
C 1.126321 1.178576 -0.229454
C -1.400952 1.460787 -0.120983
C -2.935916 -0.441250 0.029752
C -2.700259 0.928147 -0.005940
C 1.555214 -4.018847 -0.302380
C 3.525031 0.785064 0.132002
C 1.423394 2.532941 -0.545205
C -2.874907 3.206182 0.219451
C 3.811720 2.133836 -0.173890
C 2.752486 3.004320 -0.518280
H 1.019837 -1.648920 -1.469232
H 2.830132 -1.737837 0.165563
H -0.937347 -4.657811 -0.309282
H -0.830061 -3.493898 -1.668274
H -2.145897 -3.087450 1.091376
H -2.951845 -3.090899 -0.496353
H -3.947520 -0.843694 0.130789
H 2.462263 -3.758340 0.265954
H 1.808076 -4.017881 -1.390322
H 1.264133 -5.043245 -0.013598
H 4.335403 0.097222 0.401549
H 0.612583 3.216323 -0.807159
H 1.046335 -2.126331 1.910050
H -3.253620 3.981952 -0.462332
H -2.908960 3.506995 1.284650
H 4.844161 2.499074 -0.148568
H 2.960521 4.051215 -0.766288


