%chk=000235809.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235809

0 1
O 2.680125 -2.264624 0.322125
O -2.680141 2.264465 0.323195
N 1.382207 -0.458941 0.711092
N -1.382182 0.458644 0.711377
C 3.636762 -0.134151 -0.349552
C -3.636842 0.134233 -0.349157
C 4.363789 0.601098 0.793241
C 4.629901 -0.979395 -1.171007
C -4.363717 -0.601487 0.793429
C -4.630099 0.979782 -1.170157
C 5.500553 1.472769 0.243897
C 5.769957 -0.111346 -1.715079
C -5.500527 -1.472965 0.243874
C -5.770200 0.111924 -1.714440
C 0.288074 -1.327467 1.216512
C 1.052827 0.981106 0.544812
C -1.052828 -0.981347 0.544573
C -0.288004 1.326981 1.217021
C 2.558985 -1.050352 0.229005
C -2.559010 1.050227 0.229626
C 6.488158 0.640471 -0.585806
C -6.488250 -0.640359 -0.585381
H 3.169499 0.616397 -1.032952
H -3.169643 -0.616032 -1.032912
H 4.771826 -0.139024 1.510827
H 3.647704 1.224624 1.364504
H 4.100095 -1.486527 -1.999117
H 5.033254 -1.796175 -0.536604
H -4.771683 0.138339 1.511359
H -3.647549 -1.225227 1.364356
H -4.100402 1.487257 -1.998128
H -5.033395 1.796300 -0.535381
H 6.032101 1.963677 1.080940
H 5.085387 2.289701 -0.376717
H 5.376367 0.610331 -2.456078
H 6.491875 -0.746837 -2.262459
H -6.031965 -1.964216 1.080785
H -5.085418 -2.289641 -0.377114
H -5.376682 -0.609449 -2.455773
H -6.492197 0.747616 -2.261482
H 0.218392 -1.211042 2.321684
H 0.548856 -2.398859 1.022024
H 1.008654 1.234497 -0.539731
H 1.867229 1.595433 1.000365
H -1.008784 -1.234369 -0.540062
H -1.867185 -1.595824 1.000010
H -0.218209 1.210139 2.322142
H -0.548805 2.398445 1.022964
H 7.273658 1.294960 -1.006638
H 7.009969 -0.083236 0.070247
H -7.273785 -1.294699 -1.006381
H -7.010001 0.083075 0.071021


%chk=000235809-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235809

0 1
O 2.800277 -2.261410 0.300565
O -2.800887 2.261520 0.300665
N 1.375620 -0.438066 0.527165
N -1.375672 0.438474 0.525610
C 3.716658 -0.063969 -0.289321
C -3.716588 0.064332 -0.291079
C 4.554233 0.377559 0.952602
C 4.629674 -0.753205 -1.335183
C -4.552387 -0.378360 0.951631
C -4.631220 0.753843 -1.335352
C 5.730768 1.293342 0.544741
C 5.810035 0.160699 -1.739528
C -5.729079 -1.294356 0.544714
C -5.811720 -0.160304 -1.738746
C 0.302320 -1.314316 1.046146
C 1.045102 1.004747 0.373507
C -1.044986 -1.004289 0.371853
C -0.303017 1.314507 1.046279
C 2.601706 -1.008560 0.180074
C -2.601415 1.009075 0.177485
C 6.633493 0.608968 -0.508664
C -6.633419 -0.609679 -0.507108
H 3.283780 0.845528 -0.752125
H -3.283922 -0.844698 -0.754986
H 4.944718 -0.535048 1.445510
H 3.908543 0.891297 1.692858
H 4.034293 -1.028943 -2.227016
H 5.002981 -1.699917 -0.902129
H -4.942606 0.533759 1.445653
H -3.905517 -0.892321 1.690704
H -4.037089 1.030376 -2.227772
H -5.004358 1.700137 -0.901245
H 6.322041 1.562884 1.441452
H 5.333326 2.241495 0.125655
H 5.421735 1.059406 -2.263802
H 6.460852 -0.370703 -2.460551
H -6.319100 -1.564701 1.442009
H -5.331795 -2.242087 0.124526
H -5.423722 -1.058523 -2.264080
H -6.463679 0.371278 -2.458604
H 0.212886 -1.204452 2.145458
H 0.608544 -2.353699 0.840848
H 0.986166 1.275445 -0.699737
H 1.824598 1.635585 0.840867
H -0.984748 -1.274589 -0.701419
H -1.825058 -1.635292 0.838034
H -0.214926 1.204193 2.145657
H -0.608989 2.353971 0.841007
H 7.446204 1.293821 -0.819222
H 7.116329 -0.279049 -0.051188
H -7.446251 -1.294662 -0.817061
H -7.116029 0.277856 -0.048458


