%chk=000239157.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239157

0 1
O -0.584500 3.480947 2.473963
O 6.959319 0.003698 -0.617222
O 6.250730 -1.431593 -2.071138
N -5.193930 -1.955699 -0.682679
N -1.621953 2.664079 2.038067
N 6.071491 -0.622766 -1.174038
C -4.288608 -0.964893 -0.216360
C -2.291655 0.788311 0.741418
C -4.178463 -0.679555 1.166444
C -3.383447 -0.339720 -1.110673
C -3.194304 0.185943 1.632357
C -2.401272 0.519601 -0.632961
C -1.237720 1.706194 1.234323
C -6.360624 -2.267011 0.187700
C -5.578160 -1.895240 -2.119559
C 2.058695 0.066743 0.098219
C 0.157799 1.494726 0.788504
C 0.667657 0.285235 0.524783
C 3.120829 0.760438 0.706729
C 2.325622 -0.862393 -0.926300
C 4.682944 -0.385197 -0.732200
C 4.433335 0.537554 0.295909
C 3.633291 -1.088269 -1.346734
H -4.857683 -1.139755 1.880604
H -3.444316 -0.533260 -2.179275
H -3.124602 0.402346 2.700396
H -1.712743 0.994836 -1.333299
H -6.005951 -2.568974 1.189400
H -6.910481 -3.127780 -0.227619
H -7.062943 -1.426357 0.303096
H -6.155081 -0.995230 -2.384924
H -6.177888 -2.783817 -2.377669
H -4.670961 -1.929328 -2.748764
H 0.750670 2.413756 0.710519
H 0.057097 -0.622479 0.607758
H 2.916981 1.470254 1.510315
H 1.504009 -1.404229 -1.396588
H 5.269019 1.070809 0.762945
H 3.854260 -1.804522 -2.145953
H -1.069764 4.163698 3.048106


%chk=000239157-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239157

0 1
O -0.478797 3.055302 3.005653
O 7.033965 0.478852 -1.140778
O 6.497295 -1.634606 -1.818978
N -5.522454 -1.622130 -0.786440
N -1.620173 2.350754 2.404979
N 6.191122 -0.490531 -1.297264
C -4.473318 -0.877974 -0.243008
C -2.298881 0.652832 0.882683
C -4.440833 -0.541867 1.150387
C -3.386598 -0.418654 -1.056297
C -3.382491 0.205832 1.688070
C -2.332840 0.326083 -0.501158
C -1.211401 1.480823 1.469228
C -6.642117 -2.047857 0.063904
C -5.525177 -1.955706 -2.216695
C 2.131716 0.131484 -0.006625
C 0.192227 1.369440 1.054281
C 0.733105 0.283618 0.411124
C 3.112267 1.161967 0.134548
C 2.537319 -1.106998 -0.590573
C 4.798350 -0.279094 -0.854704
C 4.436456 0.964505 -0.282804
C 3.858895 -1.322330 -1.013918
H -5.242872 -0.871527 1.816394
H -3.371995 -0.629122 -2.129132
H -3.379666 0.451738 2.754949
H -1.539917 0.691048 -1.163257
H -6.306219 -2.712510 0.885628
H -7.371797 -2.605411 -0.543840
H -7.166965 -1.182601 0.517369
H -5.554852 -1.048060 -2.853924
H -6.414342 -2.561962 -2.450014
H -4.629576 -2.543878 -2.501915
H 0.825231 2.214619 1.348827
H 0.080305 -0.574698 0.203436
H 2.833201 2.125570 0.571533
H 1.797342 -1.907376 -0.705670
H 5.195690 1.744298 -0.180242
H 4.177952 -2.267806 -1.459865
H -0.932456 3.695032 3.611709


