%chk=000245601.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245601

0 1
O 0.260805 -1.022275 2.583018
O 3.849090 -1.175451 -0.000195
O 2.009987 -0.260210 -0.951802
C -2.899335 -0.280753 -0.274548
C -1.902615 -0.547963 0.859238
C -4.260166 0.165346 0.276546
C -0.542892 -0.995943 0.314064
C -5.262790 0.436059 -0.854019
C 0.461149 -1.217281 1.409223
C -6.618960 0.880459 -0.310698
C 1.822137 -1.765808 0.970034
C 2.496691 -0.967329 -0.099551
C 4.727778 -0.473174 -0.940778
C 4.874840 0.973524 -0.522618
H -3.023941 -1.190184 -0.893233
H -2.497419 0.494418 -0.956082
H -1.772539 0.362173 1.480294
H -2.301169 -1.316933 1.550880
H -4.664120 -0.606902 0.959247
H -4.137620 1.075861 0.894666
H -0.139585 -0.233728 -0.400475
H -0.652462 -1.911956 -0.300881
H -5.388260 -0.474143 -1.472438
H -4.861253 1.211626 -1.535408
H -7.062935 0.118380 0.339859
H -6.536244 1.802699 0.275779
H -7.328131 1.071510 -1.123759
H 2.487949 -1.842238 1.866470
H 1.705362 -2.819683 0.632517
H 4.312476 -0.584608 -1.957885
H 5.657705 -1.060080 -0.825239
H 5.648487 1.484402 -1.108431
H 3.934864 1.528537 -0.664435
H 5.145917 1.063050 0.537740


%chk=000245601-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245601

0 1
O 0.560433 -1.078735 2.355493
O 3.898323 -1.043803 0.168062
O 2.170090 -0.803134 -1.384506
C -2.957612 -0.531599 -0.245750
C -1.758323 -0.536797 0.727466
C -4.121946 0.362983 0.236380
C -0.593843 -1.404389 0.216350
C -5.332657 0.360622 -0.724385
C 0.581885 -1.512964 1.176759
C -6.488970 1.260880 -0.237752
C 1.854228 -2.209206 0.627833
C 2.618583 -1.288834 -0.317647
C 4.754583 -0.108613 -0.634515
C 4.500921 1.340689 -0.213421
H -3.328243 -1.569809 -0.381871
H -2.623094 -0.187399 -1.246872
H -1.398410 0.498909 0.884246
H -2.079034 -0.900053 1.722570
H -4.452021 0.026824 1.241574
H -3.756943 1.403751 0.362229
H -0.202741 -1.037424 -0.755560
H -0.944378 -2.440366 0.010166
H -5.698757 -0.679393 -0.846854
H -5.000783 0.693349 -1.729224
H -6.857443 0.931549 0.752270
H -6.157563 2.311857 -0.138119
H -7.342784 1.240888 -0.939906
H 2.500921 -2.502165 1.467405
H 1.551922 -3.101965 0.049281
H 4.535632 -0.265180 -1.705287
H 5.779299 -0.437464 -0.400070
H 5.202372 2.010297 -0.744808
H 3.472875 1.650071 -0.465921
H 4.656277 1.468025 0.871485


