%chk=000261899.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261899

0 1
O -0.804576 -0.053038 -2.928572
O 0.803367 -0.044624 2.929162
O 4.249723 0.741923 1.461413
O -4.246377 0.760102 -1.464022
O 0.585176 -1.720130 -3.539291
O -0.594500 -1.702777 3.545762
O 5.312698 0.401198 -0.512554
O -5.310938 0.433886 0.511539
N 1.778334 0.296711 0.446439
N -1.777416 0.304908 -0.447570
C 0.666842 -0.043010 -0.289586
C -0.667764 -0.038043 0.289729
C 1.097431 -0.384781 -1.602594
C -1.100107 -0.371923 1.604194
C 2.518972 -0.256606 -1.641841
C -2.520874 -0.235515 1.643083
C 2.923831 0.169566 -0.357961
C -2.923494 0.187658 0.357504
C 3.391646 -0.508298 -2.796842
C -3.394754 -0.477558 2.799231
C 0.328711 -0.839597 -2.752606
C -0.333733 -0.826324 2.755960
C 4.276687 0.437168 0.110174
C -4.274857 0.461191 -0.111502
C -1.713609 -0.396342 -4.026120
C 1.710585 -0.388403 4.028065
C 5.515718 1.113425 2.097637
C -5.510314 1.136356 -2.101561
C -2.778821 -1.334408 -3.503305
C 2.769983 -1.335414 3.509602
C 5.861490 2.545232 1.750348
C -5.848626 2.571048 -1.758893
H 1.797717 0.549686 1.441667
H -1.795537 0.553788 -1.443839
H 3.346821 0.315320 -3.527909
H 3.099162 -1.427821 -3.336492
H 4.453368 -0.611102 -2.504858
H -3.343265 0.347558 3.528158
H -3.108824 -1.397831 3.341098
H -4.457391 -0.573206 2.508136
H -2.102178 0.599093 -4.306407
H -1.125017 -0.834685 -4.853924
H 2.105282 0.605967 4.303570
H 1.119447 -0.819190 4.858006
H 5.260739 0.969850 3.163263
H 6.292762 0.396702 1.775390
H -5.255923 0.988084 -3.166684
H -6.291099 0.424729 -1.777135
H -2.339962 -2.262094 -3.108776
H -3.365768 -0.879615 -2.689811
H -3.480780 -1.622415 -4.295429
H 2.325480 -2.262497 3.119999
H 3.359316 -0.888226 2.693624
H 3.470557 -1.623550 4.302913
H 6.123786 2.644691 0.685673
H 5.019808 3.223786 1.939665
H 6.718607 2.904283 2.332632
H -6.110157 2.675296 -0.694475
H -5.003531 3.244642 -1.950661
H -6.704056 2.932578 -2.342118


%chk=000261899-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261899

0 1
O -1.200511 0.216101 -2.853823
O 1.200705 0.220987 2.852643
O 4.289351 0.193842 1.380339
O -4.289755 0.211382 -1.380782
O 0.660061 -0.207936 -4.168790
O -0.661360 -0.192038 4.169019
O 5.341257 0.144071 -0.716456
O -5.341478 0.172493 0.716336
N 1.818618 0.163728 0.319904
N -1.818944 0.170724 -0.320639
C 0.630687 0.126736 -0.371347
C -0.631130 0.130822 0.370631
C 0.985058 0.061478 -1.782653
C -0.985640 0.072049 1.782178
C 2.431022 0.056997 -1.866047
C -2.431561 0.074427 1.865742
C 2.911956 0.126269 -0.539126
C -2.912351 0.141153 0.538632
C 3.287359 0.000613 -3.100967
C -3.287925 0.026489 3.101000
C 0.194047 -0.005814 -3.018973
C -0.194795 0.005590 3.018653
C 4.283410 0.157297 -0.035356
C -4.283737 0.176569 0.034954
C -2.051185 0.144672 -4.082992
C 2.051162 0.149745 4.081989
C 5.636996 0.266569 2.021032
C -5.637103 0.291134 -2.021271
C -2.514842 -1.291562 -4.335659
C 2.508911 -1.287593 4.339222
C 6.118695 1.717136 2.116867
C -6.110820 1.744265 -2.118109
H 1.848015 0.211808 1.361607
H -1.848185 0.215031 -1.362504
H 3.031156 0.818272 -3.797695
H 3.105887 -0.932253 -3.662999
H 4.351402 0.065731 -2.828760
H -3.028687 0.846208 3.794231
H -3.109711 -0.904618 3.666925
H -4.351753 0.094503 2.828678
H -2.890447 0.819353 -3.851060
H -1.457715 0.537560 -4.924937
H 2.893182 0.820230 3.847896
H 1.459352 0.547716 4.922725
H 5.479509 -0.186309 3.014057
H 6.338069 -0.349261 1.431132
H -5.482301 -0.163358 -3.013980
H -6.341463 -0.320360 -1.430776
H -1.654845 -1.950009 -4.542576
H -3.069864 -1.683399 -3.465825
H -3.183201 -1.316053 -5.216744
H 1.646154 -1.941811 4.548056
H 3.062430 -1.684411 3.470690
H 3.177019 -1.312132 5.220494
H 6.284659 2.139051 1.111851
H 5.384059 2.345051 2.650892
H 7.075273 1.757471 2.670382
H -6.274431 2.167779 -1.113379
H -5.372753 2.367747 -2.652596
H -7.067171 1.789470 -2.671636


