%chk=000246419.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246419

0 1
O 0.296000 0.189261 1.257147
O -1.275667 -0.295670 -2.489548
O -5.542741 0.076944 -0.831196
N 4.222657 -0.106973 -0.407655
N 0.632925 -1.224442 -0.520640
N -3.775032 -0.248857 0.657276
N -2.471970 -0.370792 0.906347
N -3.403161 -0.072139 -1.708750
C 2.824134 -0.084682 -0.939484
C 4.473172 1.016725 0.556142
C 5.232467 -0.117937 -1.518159
C 2.099778 -1.292332 -0.299999
C 3.643729 0.839865 1.826746
C 6.578638 -0.621542 -0.994413
C -0.142103 -0.405660 0.292401
C -1.611449 -0.353138 -0.089018
C -1.991672 -0.240336 -1.515695
C -4.355448 -0.066161 -0.659668
C -4.686166 -0.318636 1.834010
H 2.788244 -0.161563 -2.044881
H 2.286062 0.854856 -0.682829
H 5.554795 0.996669 0.821660
H 4.272806 2.014179 0.107286
H 4.871494 -0.812213 -2.309854
H 5.357272 0.877163 -1.997355
H 2.306108 -1.319527 0.798156
H 2.478267 -2.247725 -0.720167
H 2.559436 0.878663 1.633006
H 3.842886 -0.129900 2.299532
H 3.872154 1.622517 2.556629
H 7.046307 0.093737 -0.308295
H 6.454302 -1.561025 -0.438034
H 7.276652 -0.805725 -1.816890
H 0.294181 -1.529486 -1.434104
H -3.758361 0.043535 -2.670723
H -4.963784 -1.367521 2.042538
H -5.606714 0.259826 1.624531
H -4.196398 0.100941 2.733053


%chk=000246419-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246419

0 1
O 0.202415 -0.112946 1.357875
O -1.461207 -1.591206 -2.386108
O -5.706134 -0.373593 -0.854514
N 4.242422 0.093614 -0.375715
N 0.652195 -1.151525 -0.683276
N -3.831478 -0.002473 0.523070
N -2.487167 -0.061775 0.772359
N -3.557558 -0.974727 -1.600226
C 2.808829 0.146460 -0.736835
C 4.585706 0.886983 0.832430
C 5.178213 0.281491 -1.513326
C 2.100867 -1.208444 -0.435463
C 3.909344 0.366871 2.116099
C 6.558339 -0.366751 -1.283194
C -0.192649 -0.585053 0.247802
C -1.663281 -0.575382 -0.147598
C -2.159268 -1.088196 -1.451357
C -4.468204 -0.447318 -0.666101
C -4.671713 0.575363 1.591907
H 2.684351 0.385590 -1.812110
H 2.282032 0.938758 -0.167550
H 5.681789 0.842860 0.966175
H 4.322264 1.966983 0.688543
H 4.717693 -0.189565 -2.402096
H 5.315148 1.365660 -1.762103
H 2.272940 -1.459475 0.624046
H 2.539379 -2.006499 -1.059109
H 2.806741 0.407216 2.054102
H 4.207661 -0.679439 2.308533
H 4.219584 0.982727 2.980966
H 7.104769 0.103674 -0.446342
H 6.439206 -1.440069 -1.053260
H 7.185034 -0.263452 -2.188754
H 0.246128 -1.490237 -1.568542
H -3.959758 -1.313833 -2.481580
H -5.411167 -0.166048 1.936537
H -5.213687 1.457502 1.213506
H -3.995979 0.857152 2.410312


