%chk=000272120.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272120

0 1
O -2.673905 -4.458018 0.353068
O -2.510959 1.721851 0.468611
O -0.705520 0.664324 -2.547396
O -1.492643 -2.747158 1.249097
O -4.355385 1.577856 -0.839481
O 6.776579 3.045516 0.441651
N -0.930771 -0.639682 -0.690475
N 4.623590 2.339455 0.727313
C -2.314946 -1.049258 -1.013229
C -2.408319 -2.589123 -1.019522
C -3.300400 -0.448435 0.016856
C -0.264263 0.321224 -1.463106
C -2.110839 -3.209416 0.315102
C -3.491447 1.027593 -0.201877
C 1.007096 0.827223 -0.869303
C 1.036813 1.340777 0.434621
C 2.171836 0.836631 -1.649263
C 3.401740 1.836495 0.192400
C 2.221164 1.842854 0.967928
C 3.365259 1.327144 -1.126003
C -2.458590 -5.282843 1.546023
C -2.503440 3.182241 0.344639
C -1.064859 -5.871246 1.518100
C -3.560289 3.780210 1.248336
C 4.723481 2.604608 2.185379
C 5.761170 2.624696 -0.074167
H -2.572767 -0.672037 -2.047564
H -1.689668 -3.000360 -1.768922
H -3.407096 -2.914949 -1.385995
H -4.290739 -0.946038 -0.060908
H -2.940338 -0.641635 1.054174
H -0.576485 -0.936366 0.224311
H 0.120434 1.360093 1.033536
H 2.138595 0.457518 -2.674602
H 2.217866 2.243720 1.979166
H 4.260571 1.307920 -1.744722
H -3.256388 -6.037623 1.417245
H -2.642496 -4.660101 2.439243
H -2.653369 3.442649 -0.719408
H -1.471094 3.413182 0.662852
H -0.852837 -6.366279 0.561338
H -0.298975 -5.093761 1.659394
H -0.927339 -6.613873 2.313729
H -4.572173 3.538324 0.887716
H -3.481360 3.398526 2.273751
H -3.480900 4.873065 1.289214
H 5.770161 2.869416 2.446066
H 4.083495 3.451976 2.480558
H 4.447585 1.711020 2.768117
H 5.637462 2.437994 -1.152390


%chk=000272120-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272120

0 1
O -2.705123 -4.411516 0.627137
O -2.796540 1.842464 0.274615
O -0.746635 0.930856 -2.309406
O -1.316772 -2.678957 1.326839
O -4.389301 1.449253 -1.389739
O 6.451492 3.975659 0.779003
N -0.944661 -0.602730 -0.574672
N 4.799666 2.301537 0.801187
C -2.269380 -1.080315 -0.993048
C -2.328388 -2.628291 -0.934834
C -3.418169 -0.439160 -0.141757
C -0.283358 0.412894 -1.239595
C -2.052284 -3.204108 0.447189
C -3.617034 1.023822 -0.499839
C 1.028695 0.865205 -0.653820
C 1.502707 0.497941 0.631481
C 1.836272 1.717235 -1.449303
C 3.542734 1.828419 0.308486
C 2.738589 0.973837 1.109541
C 3.080124 2.182606 -0.991127
C -2.457834 -5.138248 1.918703
C -2.792375 3.298666 -0.078275
C -1.200074 -6.003618 1.817060
C -3.934250 4.035480 0.626692
C 5.540874 1.523811 1.816963
C 5.334527 3.531326 0.399375
H -2.400016 -0.765920 -2.044616
H -1.560841 -3.037101 -1.621397
H -3.305688 -2.996679 -1.289205
H -4.362445 -0.965524 -0.366395
H -3.183990 -0.544246 0.931155
H -0.590623 -1.005809 0.298074
H 0.909481 -0.140754 1.295879
H 1.465957 1.986035 -2.443953
H 3.067441 0.693212 2.114376
H 3.704071 2.783441 -1.659662
H -3.369937 -5.741533 2.047323
H -2.373368 -4.391146 2.726805
H -2.866003 3.385973 -1.175987
H -1.802140 3.640262 0.263085
H -1.269084 -6.702971 0.966347
H -0.298863 -5.379259 1.697235
H -1.085167 -6.597742 2.742401
H -4.912148 3.686402 0.255742
H -3.887811 3.883289 1.719156
H -3.855814 5.120336 0.425991
H 6.564194 1.928209 1.859979
H 5.084570 1.626494 2.819023
H 5.566996 0.458513 1.533894
H 4.662023 4.100350 -0.272905


