%chk=000191792.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191792

0 1
O 2.392973 0.308303 1.393233
O 2.064854 -2.846091 0.233449
O 4.325024 -1.753904 -0.067501
O 4.018094 1.731730 -1.571148
O -4.223665 0.956517 -0.655708
N 0.154740 0.054478 0.705672
N -1.291781 -1.886940 0.001910
N -3.553431 -1.243303 -0.649713
N -1.139966 4.034128 -0.411803
N -2.961963 -3.541262 -0.475378
C 1.402436 -0.661844 1.051076
C 1.934865 -1.495570 -0.160181
C 3.304307 -0.853995 -0.518577
C 3.407057 0.412355 0.355257
C -1.035035 -0.527824 0.262696
C 3.132798 1.694321 -0.449792
C -0.062791 1.461505 0.787608
C -1.989026 0.487434 0.046423
C -1.361204 1.733846 0.384019
C -2.022607 3.067343 0.312941
C -3.333779 0.169683 -0.429196
C -2.648188 -2.161498 -0.399854
H 1.257081 -1.269824 1.979230
H 1.233525 -1.523894 -1.023581
H 3.425539 -0.635174 -1.600681
H 4.361184 0.447679 0.927000
H 3.235896 2.598281 0.175003
H 2.122166 1.694421 -0.909344
H 0.707020 2.127434 1.135213
H 2.936575 -2.981558 0.714288
H 4.671593 -2.279700 -0.824010
H -0.678953 -2.613137 0.371997
H -3.039410 2.956696 -0.144218
H -2.185311 3.458923 1.346362
H 4.906261 2.046726 -1.300491
H -1.621205 4.923987 -0.514942
H -0.952783 3.693965 -1.351961
H -3.908685 -3.727976 -0.814065
H -2.278505 -4.138963 -0.925232


%chk=000191792-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191792

0 1
O 2.337888 0.844372 0.736300
O 1.424399 -2.605082 -0.165549
O 3.792271 -2.052376 0.706243
O 5.191935 0.950997 -1.706387
O -4.610078 0.665839 -0.241784
N 0.034330 0.334086 0.426669
N -1.232281 -1.755263 -0.093919
N -3.614688 -1.458923 -0.437638
N -1.689788 4.276236 0.402987
N -2.636857 -3.576904 -0.635010
C 1.352837 -0.240965 0.707478
C 1.846867 -1.229061 -0.396775
C 3.388350 -1.081770 -0.331256
C 3.602815 0.384806 0.092236
C -1.120310 -0.388283 0.146885
C 3.894305 1.306211 -1.109567
C -0.347644 1.694933 0.624149
C -2.224270 0.480316 0.124572
C -1.722550 1.806623 0.433390
C -2.544589 3.070766 0.527260
C -3.561337 -0.049975 -0.187309
C -2.525642 -2.217539 -0.387140
H 1.349931 -0.757022 1.692191
H 1.455564 -0.920742 -1.379754
H 3.890477 -1.304762 -1.289304
H 4.412390 0.463620 0.842769
H 3.852938 2.362513 -0.783255
H 3.147551 1.161007 -1.908026
H 0.389926 2.449023 0.873873
H 2.131487 -3.012265 0.413048
H 4.759008 -2.243182 0.649995
H -0.397079 -2.366185 -0.079237
H -3.371676 3.003336 -0.213296
H -3.037239 3.108919 1.518951
H 5.918601 1.430769 -1.236987
H -2.162210 5.140707 0.685344
H -1.261400 4.366452 -0.525066
H -3.569494 -3.918348 -0.851445
H -1.839040 -4.205585 -0.659634


