%chk=000237418.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237418

0 1
O -2.818667 1.209481 -1.644561
O 2.818443 1.210114 1.644953
O -7.039447 2.189531 -0.035756
O 7.038889 2.191927 0.036347
N -3.120785 -1.542728 -0.261473
N 3.121502 -1.541715 0.261312
N -6.213093 0.104238 0.478893
N 6.213241 0.106461 -0.478734
N -4.920410 1.707816 -0.835194
N 4.920014 1.709331 0.835681
N -5.036113 -2.078628 0.873668
N 5.037007 -2.076729 -0.873944
C -0.705104 -1.571495 0.297936
C 0.705833 -1.571196 -0.298100
C -1.758717 -1.603891 -0.820711
C 1.759456 -1.603459 0.820540
C -3.971029 -0.426796 -0.341515
C 3.971358 -0.425501 0.341566
C -5.149978 -0.788223 0.369143
C 5.150430 -0.786384 -0.369163
C -3.793013 -2.507032 0.479350
C 3.794060 -2.505642 -0.479703
C -3.785615 0.845152 -1.002320
C 3.785503 0.846255 1.002614
C -6.122631 1.396333 -0.126101
C 6.122344 1.398398 0.126532
C -7.438472 -0.280026 1.220645
C 7.438743 -0.277229 -1.220582
C -4.874956 3.063760 -1.450400
C 4.874101 3.065132 1.451166
H -0.852028 -0.662736 0.922894
H -0.840098 -2.432174 0.981547
H 0.852449 -0.662262 -0.922875
H 0.841120 -2.431693 -0.981882
H -1.659254 -2.523084 -1.441570
H -1.616615 -0.726177 -1.511598
H 1.660309 -2.522812 1.441211
H 1.617055 -0.725933 1.511604
H -3.393201 -3.486050 0.712038
H 3.394581 -3.484751 -0.712580
H -8.170408 0.550402 1.203969
H -7.190255 -0.518057 2.270551
H -7.898553 -1.173196 0.761166
H 7.190620 -0.514969 -2.270576
H 7.899045 -1.170433 -0.761391
H 8.170459 0.553386 -1.203603
H -3.908074 3.211634 -1.967720
H -4.988592 3.841129 -0.674787
H -5.693778 3.181924 -2.181174
H 5.692942 3.183456 2.181894
H 3.907207 3.212538 1.968596
H 4.987377 3.842702 0.675702


%chk=000237418-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000237418

0 1
O -2.666508 1.724293 0.256782
O 2.666078 1.725211 -0.256221
O -7.293435 1.506122 1.145809
O 7.293040 1.508824 -1.145497
N -3.010635 -1.127313 -0.990169
N 3.011245 -1.126536 0.990128
N -6.316477 -0.349520 0.091886
N 6.316790 -0.347331 -0.091820
N -4.994688 1.584397 0.688964
N 4.994302 1.586239 -0.688463
N -5.053967 -2.164787 -1.020679
N 5.054943 -2.163300 1.020353
C -0.759661 -0.999248 0.138430
C 0.760222 -0.998954 -0.138425
C -1.559268 -0.913444 -1.180417
C 1.559804 -0.913233 1.180442
C -3.922347 -0.252054 -0.374666
C 3.922637 -0.250811 0.374816
C -5.159918 -0.918712 -0.417061
C 5.160444 -0.917043 0.417030
C -3.737380 -2.250343 -1.350301
C 3.738397 -2.249386 1.350002
C -3.751298 1.064524 0.185870
C 3.751112 1.065830 -0.185427
C -6.268653 0.941495 0.669344
C 6.268505 0.943810 -0.668959
C -7.599309 -1.077293 0.029830
C 7.599871 -1.074686 -0.029996
C -4.980712 2.935721 1.296505
C 4.979812 2.937648 -1.295804
H -1.032906 -0.130717 0.765713
H -1.047496 -1.920497 0.683581
H 1.033172 -0.130163 -0.765475
H 1.048368 -1.919960 -0.683822
H -1.212475 -1.682173 -1.895849
H -1.408756 0.080419 -1.636392
H 1.213288 -1.682284 1.895664
H 1.408942 0.080449 1.636696
H -3.284354 -3.102367 -1.851938
H 3.285683 -3.101683 1.851455
H -8.367204 -0.435572 0.485240
H -7.520840 -2.029400 0.580681
H -7.857832 -1.297875 -1.019239
H 7.521685 -2.026707 -0.581036
H 7.858535 -1.295396 1.019011
H 8.367522 -0.432613 -0.485320
H -3.945689 3.304439 1.252541
H -5.331131 2.883630 2.340082
H -5.654400 3.607269 0.739725
H 5.653222 3.609378 -0.738908
H 3.944644 3.305955 -1.251811
H 5.330279 2.885848 -2.339379


