%chk=000201893.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201893

0 1
O -0.536594 -2.318928 -0.635825
O -0.994518 -1.666215 1.567544
O -0.360756 1.449379 -0.399116
O 0.575477 3.362098 -1.327874
N -1.721066 3.131803 -0.938417
C -0.698709 -1.188535 0.241610
C -2.072387 -3.669964 0.691023
C -1.697517 -3.172913 -0.706628
C -2.185589 -2.477264 1.642684
C 0.648714 -0.533628 0.326886
C 0.830952 0.821160 -0.021024
C 1.766638 -1.257472 0.758413
C 2.074871 1.448136 0.047427
C 3.023104 -0.646469 0.835969
C 3.172475 0.696822 0.480804
C -0.390782 2.740701 -0.957429
C -2.138175 4.293892 -1.751411
H -1.523079 -0.543423 -0.120857
H -3.008314 -4.254305 0.669593
H -1.281092 -4.356258 1.058630
H -1.345770 -3.985527 -1.368034
H -2.519346 -2.620134 -1.192868
H -3.063351 -1.845207 1.425029
H -2.191938 -2.779277 2.705823
H 1.635144 -2.307995 1.031247
H 2.196110 2.495364 -0.241060
H 3.883464 -1.220969 1.172312
H 4.152902 1.170838 0.539310
H -2.441389 2.466122 -0.668947
H -2.552576 3.990345 -2.727544
H -1.279159 4.968736 -1.939988
H -2.901146 4.867889 -1.196683


%chk=000201893-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000201893

0 1
O -0.405789 -2.447175 -0.614376
O -0.969414 -1.708251 1.623333
O -0.399266 1.521252 -0.120130
O 0.469326 3.040238 -1.750436
N -1.743654 3.128884 -0.957720
C -0.584986 -1.283518 0.265170
C -2.155591 -3.660198 0.658062
C -1.676814 -3.196392 -0.731192
C -2.260708 -2.432264 1.583479
C 0.730166 -0.555448 0.357476
C 0.828124 0.838135 0.130439
C 1.903141 -1.269367 0.697827
C 2.061387 1.517470 0.231763
C 3.144763 -0.609304 0.801020
C 3.219441 0.783650 0.565822
C -0.465812 2.627922 -1.028299
C -2.181056 4.261268 -1.777692
H -1.397510 -0.644329 -0.146477
H -3.136612 -4.168567 0.577177
H -1.426207 -4.375476 1.078338
H -1.457185 -4.040400 -1.403700
H -2.444557 -2.544364 -1.206502
H -3.058217 -1.743903 1.221419
H -2.471894 -2.708822 2.628386
H 1.821947 -2.346661 0.868492
H 2.116218 2.590066 0.037023
H 4.046940 -1.172531 1.061537
H 4.179793 1.305134 0.642351
H -2.385097 2.682829 -0.301715
H -3.010149 3.973349 -2.450118
H -1.326866 4.586394 -2.392362
H -2.507263 5.109182 -1.147797


