%chk=000261793.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261793

0 1
O -1.441284 -2.382922 -0.825327
O -2.381938 -2.539901 1.214887
O 6.040233 0.651649 -0.366557
N -1.889384 1.928382 -0.317994
N 1.002756 -1.516265 0.208897
C -2.053358 0.465947 -0.536796
C -1.280673 -0.420179 0.530828
C -2.844556 1.085318 1.830689
C -3.577590 0.144810 -0.403589
C -1.663940 0.098532 1.944257
C -4.008013 0.429530 1.057244
C -2.371437 2.330362 1.045241
C 0.203745 -0.357382 0.314205
C -0.554797 2.481085 -0.669493
C -4.424825 0.929113 -1.421850
C -1.783294 -1.866137 0.412174
C 1.025927 0.768253 0.241349
C 0.597766 2.185356 0.308263
C 2.381221 0.312682 0.065237
C -4.238394 0.420028 -2.849367
C 2.341052 -1.120085 0.027890
C 3.618692 0.978248 -0.061658
C 3.505636 -1.901764 -0.137714
C -1.920781 -3.717260 -1.137629
C 4.744658 0.189218 -0.223807
C 4.707402 -1.241575 -0.264614
C 6.246896 2.082969 -0.347693
H -1.682564 0.203119 -1.555164
H -3.182346 1.382903 2.846733
H -3.729177 -0.941327 -0.616971
H -0.795581 0.590391 2.420929
H -1.932715 -0.743555 2.613380
H -4.304970 -0.513872 1.552228
H -4.896138 1.083785 1.090326
H -3.217458 3.033136 0.881898
H -1.601527 2.881138 1.622586
H -0.686910 3.583429 -0.760844
H -0.286506 2.113976 -1.685642
H -4.167622 2.007909 -1.374460
H -5.493498 0.857477 -1.140881
H 0.296370 2.441390 1.347632
H 1.451657 2.854892 0.076372
H 0.657594 -2.449692 0.068142
H -3.202179 0.543524 -3.186618
H -4.493095 -0.640901 -2.942405
H -4.874138 0.974238 -3.549152
H 3.655192 2.059221 -0.029903
H 3.447499 -2.986458 -0.161559
H -2.986393 -3.656188 -1.379764
H -1.755920 -4.392883 -0.291566
H -1.321596 -3.992823 -2.011743
H 5.646548 -1.775437 -0.396346
H 5.719673 2.554184 -1.182094
H 7.334216 2.155705 -0.477903
H 5.938766 2.498808 0.615818


%chk=000261793-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000261793

0 1
O -1.372664 -2.508938 -0.804584
O -2.554826 -2.528921 1.193891
O 6.131242 0.681626 -0.360643
N -1.870110 1.859732 -0.241374
N 1.042706 -1.531096 0.255669
C -2.083569 0.435463 -0.513707
C -1.276216 -0.483697 0.550140
C -2.879729 1.050644 1.854646
C -3.608375 0.131566 -0.404375
C -1.677972 0.073564 1.971699
C -4.047431 0.386229 1.081033
C -2.419255 2.303727 1.069792
C 0.225402 -0.385635 0.290783
C -0.621728 2.500168 -0.690281
C -4.446115 0.958035 -1.411997
C -1.790260 -1.919985 0.408666
C 1.046651 0.750719 0.170505
C 0.633632 2.203952 0.176266
C 2.412885 0.276712 0.047330
C -4.147377 0.644461 -2.893819
C 2.378636 -1.156771 0.087659
C 3.661587 0.945063 -0.099365
C 3.549112 -1.938701 -0.030504
C -1.972876 -3.832132 -1.107479
C 4.826684 0.159355 -0.211955
C 4.774161 -1.268566 -0.180951
C 6.264557 2.135227 -0.396388
H -1.700717 0.192898 -1.519904
H -3.210880 1.347944 2.867894
H -3.759714 -0.937579 -0.655557
H -0.813320 0.597046 2.417589
H -1.942511 -0.769403 2.632923
H -4.329333 -0.560395 1.575188
H -4.931553 1.052385 1.103588
H -3.268848 3.007027 0.928004
H -1.642674 2.840824 1.652710
H -0.791319 3.595969 -0.713838
H -0.424643 2.173903 -1.729374
H -4.271717 2.034279 -1.222324
H -5.517744 0.759340 -1.206001
H 0.451531 2.563618 1.211914
H 1.469800 2.820071 -0.209449
H 0.675208 -2.469469 0.109651
H -3.119377 0.940100 -3.171042
H -4.259067 -0.436705 -3.105408
H -4.839377 1.191272 -3.560410
H 3.704750 2.038179 -0.120687
H 3.516996 -3.033300 -0.000562
H -3.066460 -3.734159 -1.214860
H -1.756292 -4.551086 -0.299408
H -1.508443 -4.139842 -2.054860
H 5.715757 -1.817820 -0.273553
H 5.712775 2.572632 -1.252762
H 7.341720 2.326288 -0.514795
H 5.905604 2.598287 0.544781


