%chk=000236029.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236029

0 1
O 2.899405 0.129554 0.054957
O 1.330299 0.237335 -1.567726
O -3.616436 -1.630644 0.143452
N -1.538346 0.184620 0.044918
N -2.768681 0.475304 -0.486797
N -4.944211 -0.233369 -1.115646
C 0.729275 0.740198 0.788867
C 1.259297 2.079573 1.371838
C 0.563672 3.202126 0.585407
C -0.657725 1.112527 0.252915
C -0.754612 2.608356 0.055293
C 0.738839 -0.375281 1.850033
C 1.616429 0.335412 -0.400259
C 0.496783 -1.750932 1.294923
C 3.892534 -0.368564 -0.897907
C 1.300192 -2.784160 1.538728
C 3.644996 -1.836536 -1.173395
C -3.739666 -0.577421 -0.439117
H 1.013804 2.149617 2.447267
H 2.360153 2.141713 1.304411
H 0.384492 4.085875 1.219709
H 1.199279 3.543372 -0.252233
H -0.897218 2.854217 -1.014420
H -1.622380 3.021605 0.601979
H -0.044474 -0.164163 2.611043
H 1.712476 -0.340041 2.386587
H -0.411840 -1.854008 0.689191
H 3.843529 0.251369 -1.810124
H 4.826367 -0.179316 -0.338611
H -3.048666 1.432793 -0.715997
H 1.106393 -3.777103 1.159238
H 2.200131 -2.726297 2.131501
H 2.745932 -1.978667 -1.793217
H 3.473456 -2.394855 -0.241796
H 4.487655 -2.299883 -1.696869
H -4.920965 0.376215 -1.918851
H -5.604069 -0.999137 -1.220391


%chk=000236029-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236029

0 1
O 2.939399 0.013354 0.158631
O 1.423511 0.483296 -1.545199
O -3.699795 -1.726787 -0.044400
N -1.563058 0.084542 0.127727
N -2.797923 0.432687 -0.394169
N -4.953321 -0.092007 -1.140496
C 0.721876 0.703661 0.839078
C 1.136463 2.103328 1.416796
C 0.565120 3.127563 0.401594
C -0.662993 1.023833 0.259617
C -0.796692 2.517801 -0.040105
C 0.744291 -0.409919 1.934610
C 1.684135 0.378336 -0.323539
C 0.453481 -1.819092 1.451292
C 3.970981 -0.347250 -0.865793
C 1.290469 -2.868696 1.645027
C 3.807828 -1.801754 -1.314172
C -3.804812 -0.558074 -0.494324
H 0.649328 2.225030 2.404290
H 2.226337 2.187184 1.561061
H 0.452781 4.135429 0.836408
H 1.236164 3.211732 -0.471813
H -1.007332 2.708647 -1.111284
H -1.636014 2.949335 0.546251
H -0.020428 -0.121343 2.684902
H 1.731986 -0.383426 2.430501
H -0.509984 -1.959176 0.944752
H 3.875775 0.348904 -1.718105
H 4.923581 -0.178094 -0.338286
H -2.978082 1.387520 -0.730285
H 1.027304 -3.878235 1.308210
H 2.259472 -2.748893 2.148072
H 2.855265 -1.941065 -1.851031
H 3.825868 -2.484510 -0.447901
H 4.635525 -2.075367 -1.995144
H -5.027277 0.813692 -1.599191
H -5.723132 -0.750784 -1.224682


