%chk=000261965.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261965

0 1
O 1.886986 2.069716 0.504192
O -1.937268 -1.985019 -0.438354
O -0.891153 2.525740 0.589718
O 0.842159 -2.439495 -0.560176
N 2.683851 -0.566846 -0.390620
N -2.725332 0.633745 0.495995
C 5.125951 -0.501530 0.098442
C -5.197296 0.557614 0.178605
C 3.868985 0.313091 -0.287556
C -3.901768 -0.259055 0.392399
C 1.406524 -0.178320 -0.164473
C -1.450055 0.256316 0.239530
C 0.958039 1.079447 0.198175
C -1.003568 -0.999258 -0.132991
C 5.578667 -1.410388 -1.048372
C 6.243355 0.468481 0.496403
C -5.233185 1.175537 -1.221532
C -6.405742 -0.357746 0.402649
C -0.434335 1.416390 0.371594
C 0.387672 -1.334213 -0.317367
C 1.857086 3.209056 -0.402764
C -1.892945 -3.138436 0.449574
H 4.881060 -1.139468 0.986119
H -5.238196 1.382951 0.934587
H 3.674760 1.115952 0.473855
H 4.018693 0.841470 -1.255889
H -3.969833 -0.871860 1.320476
H -3.749645 -0.991127 -0.444365
H 2.854590 -1.553062 -0.629487
H -2.902406 1.622565 0.714788
H 5.822579 -0.838185 -1.950859
H 6.477548 -1.975242 -0.772999
H 4.812512 -2.143639 -1.322736
H 6.519920 1.136622 -0.326844
H 7.149902 -0.074006 0.789981
H 5.951981 1.094896 1.347851
H -5.217843 0.408178 -2.005110
H -6.139216 1.773547 -1.370461
H -4.374437 1.832610 -1.400627
H -6.410493 -1.205166 -0.293122
H -7.345084 0.187173 0.249688
H -6.428024 -0.763277 1.419952
H 0.888879 3.717431 -0.315855
H 2.050559 2.886639 -1.426114
H 2.663512 3.834985 -0.010235
H -0.928551 -3.648633 0.334873
H -2.709653 -3.755195 0.063809
H -2.064042 -2.832190 1.481851


%chk=000261965-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261965

0 1
O 2.070330 2.002678 0.368850
O -2.049886 -1.955111 -0.577320
O -0.579731 2.177812 1.495720
O 0.599769 -2.121954 -1.706052
N 2.497669 -0.385936 -1.297427
N -2.481551 0.448714 1.087718
C 4.578891 -0.086328 0.110040
C -4.846419 0.593760 0.228685
C 3.815912 0.260739 -1.200849
C -3.799152 -0.203898 1.060649
C 1.330437 -0.065785 -0.676515
C -1.317106 0.120672 0.466285
C 1.044679 1.062200 0.105595
C -1.028617 -1.008573 -0.315735
C 4.817047 -1.606425 0.249943
C 5.909007 0.699577 0.143850
C -4.428635 0.685664 -1.255926
C -6.231231 -0.076678 0.387270
C -0.247487 1.196670 0.724001
C 0.263163 -1.141247 -0.935003
C 1.734084 3.420221 0.103465
C -1.701994 -3.373765 -0.326167
H 3.945158 0.262792 0.948328
H -4.907311 1.622422 0.645022
H 3.693625 1.353119 -1.262135
H 4.409561 -0.079785 -2.071557
H -4.159507 -0.292881 2.105354
H -3.683351 -1.211803 0.636093
H 2.411143 -1.280212 -1.812198
H -2.386982 1.343948 1.602791
H 5.454691 -1.985535 -0.573094
H 5.328379 -1.835617 1.202639
H 3.866269 -2.170215 0.236124
H 6.563775 0.411918 -0.702155
H 6.460920 0.493472 1.078937
H 5.734061 1.790171 0.088467
H -4.324052 -0.324330 -1.694120
H -5.183490 1.242691 -1.840809
H -3.459129 1.202217 -1.372319
H -6.213101 -1.110519 -0.007356
H -7.002316 0.482749 -0.172575
H -6.545600 -0.120455 1.447322
H 0.921400 3.750101 0.770599
H 1.438710 3.558052 -0.955564
H 2.660535 3.977473 0.313105
H -0.899018 -3.694136 -1.009025
H -2.629471 -3.933842 -0.523464
H -1.388380 -3.516009 0.726710


