%chk=000246034.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246034

0 1
O -4.537235 1.960124 0.060028
O -3.099620 -4.344712 -0.499892
O -0.439838 1.524797 -2.057149
O 5.047565 0.878404 3.073089
O 3.456243 -0.551427 3.384165
N -2.465416 -0.759815 -0.154296
N 0.114026 0.239373 -0.233589
N 3.979279 0.369715 2.775984
C -2.011702 -0.232768 -1.476588
C -3.093851 0.237539 0.752527
C -3.249709 -2.023594 -0.281466
C -3.033331 0.568516 -2.276123
C -0.735657 0.628092 -1.293244
C -4.572042 0.591829 0.518831
C -2.259648 -3.201657 -0.240752
C 1.355262 0.847582 0.110184
C 2.035016 0.340414 1.235398
C 1.918066 1.910630 -0.630166
C 3.263307 0.907781 1.590251
C 3.142604 2.452837 -0.247856
C 3.832511 1.959742 0.866069
H -1.684303 -1.118457 -2.096479
H -2.504792 1.189496 0.704880
H -2.963291 -0.155889 1.787120
H -3.857501 -2.085911 -1.211560
H -3.971099 -2.135072 0.557459
H -3.410470 1.442276 -1.714052
H -3.896005 -0.039066 -2.562294
H -2.584823 0.975070 -3.195379
H -5.056722 -0.025614 -0.256644
H -5.158955 0.542136 1.452131
H -1.491934 -3.142173 -1.031739
H -1.775621 -3.305657 0.744583
H -0.214632 -0.506002 0.396588
H 1.627327 -0.480237 1.832237
H 1.387107 2.309636 -1.506631
H -5.440157 2.329751 0.017879
H -2.612870 -5.170230 -0.315952
H 3.571301 3.275048 -0.825062
H 4.794211 2.382794 1.168808


%chk=000246034-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246034

0 1
O -4.659020 2.018094 0.177847
O -2.717505 -4.380444 -0.323734
O -0.415415 1.494807 -2.407596
O 4.815080 0.707243 3.265345
O 2.954601 -0.577276 3.556713
N -2.440154 -0.653621 -0.194884
N -0.008083 0.385613 -0.364006
N 3.653410 0.285105 2.893365
C -2.085636 -0.128092 -1.548250
C -3.044348 0.292491 0.782241
C -3.045553 -2.011479 -0.198244
C -3.180420 0.647285 -2.315106
C -0.761763 0.694658 -1.490038
C -4.556663 0.626401 0.655325
C -1.975950 -3.112604 -0.273650
C 1.264204 0.861873 0.016649
C 1.819500 0.363602 1.222273
C 1.997997 1.810456 -0.754648
C 3.087060 0.820105 1.629190
C 3.265667 2.243583 -0.310846
C 3.834090 1.759187 0.885333
H -1.824293 -1.021139 -2.154766
H -2.503038 1.255272 0.731123
H -2.857364 -0.130574 1.787242
H -3.760274 -2.158198 -1.036291
H -3.615636 -2.155509 0.737036
H -3.547410 1.508249 -1.732362
H -4.034155 -0.018003 -2.541772
H -2.760544 1.018060 -3.264976
H -5.053015 -0.075417 -0.046502
H -5.043276 0.533325 1.648427
H -1.346057 -2.983559 -1.180204
H -1.320827 -3.057960 0.621587
H -0.521015 -0.286139 0.240189
H 1.290891 -0.365116 1.844517
H 1.559523 2.187087 -1.681330
H -5.610008 2.271386 0.069517
H -2.083490 -5.139418 -0.354771
H 3.817600 2.973153 -0.912271
H 4.813891 2.082817 1.243627


