%chk=000228781.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228781

0 1
O 2.619416 0.969962 0.380218
O 2.575309 -1.157690 -0.593748
C 4.758501 -0.182575 -0.010769
C 3.959809 0.799878 0.883070
C 3.912707 -1.472997 -0.157474
C 1.870541 -0.252834 0.273443
C 0.592922 0.115693 -0.473806
C -0.664043 -0.225144 0.329911
C 4.989576 0.443800 -1.389417
C 6.093062 -0.519648 0.665096
C -1.934722 0.154558 -0.442764
C -3.198807 -0.184601 0.358416
C -4.469643 0.194981 -0.413732
C -5.734265 -0.144196 0.386412
C -7.006314 0.234916 -0.385037
C -8.268455 -0.100232 0.406705
H 3.908220 0.464495 1.931809
H 4.357616 1.828782 0.840242
H 4.275672 -2.125929 -0.970299
H 3.856261 -2.045877 0.782539
H 1.755910 -0.708471 1.273940
H 0.589215 -0.407802 -1.455226
H 0.623123 1.199912 -0.720333
H -0.679048 -1.307338 0.566862
H -0.645185 0.304085 1.303093
H 4.019156 0.677891 -1.856738
H 5.558618 1.375716 -1.327259
H 5.525265 -0.231162 -2.062916
H 5.957978 -0.969543 1.653921
H 6.677993 -1.223241 0.061160
H 6.711149 0.376665 0.793612
H -1.953859 -0.371031 -1.417302
H -1.919919 1.235315 -0.683756
H -3.179953 0.341134 1.332582
H -3.213953 -1.265190 0.598931
H -4.455010 1.275571 -0.654299
H -4.488712 -0.330139 -1.388229
H -5.716909 0.380421 1.360950
H -5.750472 -1.224377 0.627650
H -7.026045 -0.291044 -1.359605
H -6.992292 1.316023 -0.625495
H -8.299440 0.435309 1.362334
H -9.170511 0.173061 -0.151937
H -8.332461 -1.171306 0.629641


%chk=000228781-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000228781

0 1
O 3.013798 1.430176 -0.140476
O 2.208802 -0.846577 -0.095910
C 4.682264 -0.442623 -0.064429
C 4.336823 1.010949 0.363875
C 3.504355 -1.336315 0.413365
C 1.970413 0.528249 0.352351
C 0.633626 0.997135 -0.206096
C -0.565513 0.183053 0.326634
C 4.833288 -0.527979 -1.601296
C 5.981812 -0.890013 0.643432
C -1.914471 0.683219 -0.236004
C -3.125196 -0.132778 0.269643
C -4.477182 0.375436 -0.280332
C -5.688976 -0.448090 0.211065
C -7.040971 0.067047 -0.333731
C -8.246211 -0.764391 0.156573
H 4.348077 1.088254 1.475749
H 5.053504 1.736325 -0.056470
H 3.598634 -2.366418 0.030663
H 3.477452 -1.361312 1.527512
H 1.998198 0.537201 1.472472
H 0.685961 0.928106 -1.308898
H 0.519951 2.067337 0.051583
H -0.420079 -0.882806 0.067097
H -0.590221 0.238405 1.435577
H 3.905184 -0.201200 -2.099035
H 5.661854 0.116999 -1.949705
H 5.052213 -1.565282 -1.917414
H 5.889591 -0.834122 1.745440
H 6.235446 -1.933113 0.376202
H 6.833306 -0.252035 0.340918
H -1.884919 0.644445 -1.345009
H -2.053948 1.751397 0.033711
H -3.148446 -0.106235 1.379412
H -2.991183 -1.198003 -0.012447
H -4.614571 1.438128 0.010819
H -4.449809 0.359250 -1.390175
H -5.715212 -0.437892 1.321081
H -5.556403 -1.509651 -0.086080
H -7.012022 0.060584 -1.442633
H -7.174393 1.126558 -0.033221
H -8.316287 -0.747240 1.260776
H -9.199285 -0.376705 -0.248412
H -8.151250 -1.821672 -0.155778


