%chk=000267317.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267317

0 1
O 0.629651 -1.244047 -0.240680
O 1.101664 1.643087 1.607188
O -0.288845 1.676219 -1.546266
O 3.179977 -0.096920 -1.216449
O 3.016324 -2.901743 1.015477
O 3.495019 -2.853884 -1.202780
O 2.249289 3.448961 0.864273
O -1.263806 3.488099 -0.590230
O 5.371820 0.201598 -0.732933
N -1.645420 -1.039052 0.206219
N -2.793106 -2.397933 1.664004
N -3.530322 0.485174 -0.449649
N -5.630064 -0.094034 0.671663
N -5.833084 -1.892387 2.193698
C 1.167306 1.038811 0.296484
C -0.264763 0.999571 -0.274576
C 1.567333 -0.433584 0.527946
C -0.533626 -0.491660 -0.606691
C 2.984524 -0.773276 0.043639
C -2.963616 -0.567096 0.227192
C 3.187681 -2.272019 -0.199166
C -1.604076 -2.161276 1.105179
C -3.666157 -1.425811 1.143315
C 1.645985 2.921847 1.762708
C -0.893301 2.938120 -1.593583
C -5.052169 -1.150873 1.348438
C 4.475503 0.335385 -1.525161
C 1.342170 3.386776 3.137048
C -0.927989 3.371461 -3.012228
C -4.851856 0.653947 -0.173149
C 4.441015 0.933322 -2.880452
C 3.175359 -4.347077 1.028409
H 1.868506 1.602028 -0.368018
H -1.009180 1.462730 0.422285
H 1.443874 -0.742113 1.595546
H -0.705797 -0.691595 -1.694888
H 3.751432 -0.411968 0.784032
H -0.684091 -2.712906 1.259548
H 0.580918 4.187749 3.112182
H 2.238538 3.805410 3.622619
H 0.944214 2.584712 3.781378
H -0.366563 2.694854 -3.677596
H -0.511781 4.385738 -3.124652
H -1.968897 3.401198 -3.379059
H -5.365006 1.487542 -0.683581
H 3.430276 0.916791 -3.324994
H 4.785918 1.980448 -2.859090
H 5.108477 0.380802 -3.564720
H 2.366806 -4.802220 0.447910
H 4.152836 -4.617009 0.615008
H 3.101084 -4.584137 2.095109
H -6.810609 -1.678964 2.313575
H -5.440174 -2.675199 2.693421


%chk=000267317-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267317

0 1
O 0.558023 -1.125636 -0.855708
O 1.048355 1.766671 1.288347
O -0.634990 1.836544 -1.765444
O 3.347392 -0.126021 -1.135925
O 2.390407 -2.940084 1.003671
O 3.786762 -2.868388 -0.866037
O 2.383681 3.414280 0.293567
O -0.867412 3.734594 -0.429443
O 5.408927 0.055941 -0.052788
N -1.680117 -1.117131 -0.010646
N -2.600060 -2.773879 1.287554
N -3.573493 0.506505 0.006626
N -5.475385 -0.322242 1.331231
N -5.463102 -2.410961 2.436123
C 0.970541 1.054207 0.003667
C -0.483052 1.030097 -0.535678
C 1.331424 -0.431771 0.210321
C -0.728062 -0.449046 -0.938231
C 2.811361 -0.779484 0.062439
C -2.960358 -0.667797 0.342832
C 3.063945 -2.296168 -0.032531
C -1.525898 -2.389108 0.574653
C -3.506335 -1.705319 1.146947
C 1.730306 3.012941 1.276215
C -0.877387 3.211845 -1.563165
C -4.824059 -1.492057 1.649312
C 4.719515 0.228559 -1.077185
C 1.509824 3.730773 2.581497
C -1.149591 3.892932 -2.881439
C -4.827665 0.591600 0.545834
C 5.153607 0.814952 -2.394611
C 2.587811 -4.411283 1.080301
H 1.643957 1.526369 -0.732394
H -1.193608 1.398087 0.222209
H 0.989721 -0.776754 1.205792
H -1.087196 -0.535471 -1.976196
H 3.356771 -0.410277 0.954707
H -0.611806 -2.961724 0.442910
H 0.546690 4.270319 2.518775
H 2.313380 4.462922 2.749018
H 1.446367 3.021376 3.421179
H -0.434734 3.553737 -3.648615
H -1.087441 4.983318 -2.755745
H -2.163688 3.626525 -3.230159
H -5.385799 1.505990 0.324010
H 4.470664 1.626987 -2.696004
H 6.180722 1.196959 -2.310971
H 5.109592 0.035620 -3.175494
H 2.237656 -4.887422 0.149575
H 3.656067 -4.639588 1.229126
H 1.988065 -4.729701 1.943827
H -6.404277 -2.207792 2.766407
H -4.996820 -3.281948 2.680637


