%chk=000277852.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277852

0 1
O 5.653104 -1.965435 -0.821173
O 6.097382 -0.128262 0.226255
O -3.781687 3.047590 -0.100277
O -1.653673 3.210891 0.215547
O -4.845730 -2.998690 -0.591649
O -5.978520 -1.154798 -0.654494
N 5.341833 -0.883212 -0.365863
N 1.044763 0.428451 0.446736
N -0.144957 1.123803 0.323290
N -2.681659 2.548773 0.032330
N -4.940080 -1.783439 -0.536972
C 3.869384 -0.388077 -0.563988
C 3.426213 0.219497 0.804716
C 3.029889 -1.571575 -1.020190
C 3.956857 0.687725 -1.648073
C 2.166095 1.065796 0.653576
C 3.245486 -0.834731 1.896390
C 2.337125 2.545114 0.789990
C -1.306834 0.409237 0.117930
C -2.556932 1.101679 -0.027296
C -1.310758 -1.023943 0.040024
C -3.743850 0.365029 -0.241453
C -3.705611 -1.019012 -0.312592
C -2.471583 -1.719547 -0.168221
H 4.257694 0.909062 1.139871
H 3.378576 -1.975880 -1.982156
H 3.058789 -2.407879 -0.307788
H 1.975474 -1.285937 -1.142080
H 4.592053 1.533536 -1.350424
H 2.962465 1.087757 -1.887994
H 4.363837 0.292836 -2.590555
H 2.443009 -1.547031 1.660373
H 4.165094 -1.409674 2.065029
H 2.982989 -0.368474 2.855463
H 3.391898 2.859314 0.750431
H 1.947224 2.907540 1.756231
H 1.824063 3.112402 -0.001953
H -0.182745 2.171188 0.397640
H -0.359079 -1.553679 0.157336
H -4.703106 0.904698 -0.352143
H -2.481293 -2.816841 -0.227626


%chk=000277852-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000277852

0 1
O 5.832402 -1.990380 -0.540039
O 6.245087 0.075673 0.313733
O -3.764409 3.147006 -0.244846
O -1.513637 3.216866 0.091264
O -5.095054 -2.986677 -0.349091
O -6.188572 -0.988085 -0.534335
N 5.474601 -0.796120 -0.239771
N 1.013374 0.276303 0.474846
N -0.158179 1.010971 0.308633
N -2.639529 2.550969 -0.067188
N -5.119144 -1.693316 -0.368760
C 4.000573 -0.330060 -0.570836
C 3.414917 0.155295 0.819170
C 3.237792 -1.505250 -1.192839
C 4.166383 0.838872 -1.571389
C 2.131949 0.965041 0.624452
C 3.230551 -1.007283 1.824284
C 2.191202 2.483111 0.639223
C -1.361386 0.359541 0.148952
C -2.595123 1.088973 -0.039093
C -1.431507 -1.072283 0.161517
C -3.824013 0.413846 -0.207910
C -3.837386 -0.984613 -0.190487
C -2.643302 -1.736983 -0.004521
H 4.176679 0.847796 1.223669
H 3.647915 -1.756763 -2.184737
H 3.292798 -2.409505 -0.567984
H 2.178569 -1.217897 -1.303924
H 4.734834 1.672435 -1.126825
H 3.170807 1.200709 -1.880729
H 4.696723 0.499302 -2.478092
H 2.418115 -1.682682 1.513586
H 4.161532 -1.591645 1.931930
H 2.970012 -0.605543 2.818906
H 3.227793 2.838775 0.727377
H 1.619854 2.896428 1.495169
H 1.758416 2.927936 -0.279421
H -0.211537 2.050038 0.295882
H -0.499084 -1.619505 0.309531
H -4.746223 0.983014 -0.350058
H -2.701592 -2.828508 0.004949


