%chk=000215169.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215169

0 1
O -0.550764 -2.023974 1.982491
O 1.501458 -2.569957 3.693613
N 2.750112 -1.811609 0.292385
C -0.757708 -0.964835 1.010068
C -1.068830 0.266481 1.877444
C -1.931326 -1.395773 0.110540
C 1.724257 -2.801375 2.296744
C 0.376629 -3.059666 1.598198
C 2.497402 -1.582000 1.744186
C -0.017042 1.328715 1.728824
C -2.103876 -0.455871 -1.046836
C 2.529965 -0.575588 -0.521346
C 2.806063 -0.883234 -2.000188
C 2.483787 0.331345 -2.880668
C 0.859494 1.619800 2.784000
C -3.157359 0.470655 -1.061192
C 0.094184 2.034578 0.518992
C -1.200173 -0.492851 -2.121642
C 2.673228 0.018648 -4.362816
C 1.837823 2.606863 2.629204
C -3.303445 1.349379 -2.138481
C 1.073505 3.018140 0.370466
C -1.352093 0.386670 -3.195762
C 1.948535 3.306092 1.424095
C -2.402266 1.310837 -3.206574
H 0.169996 -0.819957 0.399302
H -1.167753 -0.064316 2.935627
H -2.063229 0.687842 1.620699
H -1.749590 -2.429362 -0.252808
H -2.856793 -1.481248 0.714967
H 2.357204 -3.717199 2.283478
H -0.104442 -3.974183 1.993616
H 0.491272 -3.131190 0.503836
H 3.427563 -1.450993 2.335972
H 1.899871 -0.661309 1.927293
H 3.143022 0.287094 -0.183462
H 1.457314 -0.274299 -0.386846
H 3.706708 -2.153946 0.158771
H 3.861538 -1.183728 -2.142455
H 2.204555 -1.758244 -2.318354
H 3.127133 1.186259 -2.593268
H 1.441943 0.664615 -2.698437
H 0.779496 1.081300 3.726659
H -3.866241 0.505170 -0.236493
H -0.589664 1.814794 -0.302555
H -0.380472 -1.210559 -2.120468
H 0.707012 -1.992266 3.809648
H 2.018045 -0.796112 -4.691734
H 3.703725 -0.283195 -4.583621
H 2.448958 0.892929 -4.984201
H 2.514181 2.831079 3.452805
H -4.123872 2.065531 -2.144937
H 1.153977 3.565325 -0.567539
H -0.651053 0.350113 -4.029045
H 2.709106 4.074627 1.306666
H -2.519170 1.994363 -4.044464


%chk=000215169-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000215169

0 1
O -0.444766 -1.410517 2.239610
O 2.060021 -1.799435 3.550112
N 2.352905 -1.539339 -0.219286
C -0.908244 -0.589511 1.096273
C -1.335792 0.770828 1.692904
C -2.083722 -1.300798 0.365305
C 1.891624 -2.233921 2.155871
C 0.409829 -2.560588 1.882741
C 2.499001 -1.170652 1.211357
C -0.169034 1.593642 2.213179
C -2.381217 -0.683349 -0.993629
C 2.883364 -0.517209 -1.156877
C 2.720435 -0.958103 -2.623524
C 3.272294 0.078234 -3.628777
C 0.248417 1.499028 3.566333
C -3.586643 0.020838 -1.241626
C 0.555233 2.448363 1.341404
C -1.430024 -0.789010 -2.044252
C 3.066885 -0.348661 -5.098023
C 1.364165 2.230525 4.034512
C -3.839860 0.603564 -2.505434
C 1.670290 3.183320 1.805159
C -1.678451 -0.207836 -3.306674
C 2.080893 3.074345 3.154289
C -2.885666 0.492229 -3.542552
H -0.070955 -0.456161 0.381712
H -2.057147 0.559493 2.505249
H -1.875388 1.326082 0.902749
H -1.806677 -2.365252 0.237668
H -2.976461 -1.275406 1.017504
H 2.472333 -3.175720 2.084972
H 0.094411 -3.383967 2.547783
H 0.273320 -2.853675 0.824131
H 3.559840 -1.018768 1.520860
H 1.983575 -0.205272 1.376197
H 3.959582 -0.279604 -0.960720
H 2.319107 0.421676 -0.985950
H 2.789602 -2.455504 -0.408923
H 3.239204 -1.928293 -2.780130
H 1.646478 -1.140050 -2.825602
H 4.352687 0.238112 -3.436312
H 2.776546 1.054834 -3.454092
H -0.311420 0.851543 4.252383
H -4.333130 0.108020 -0.442212
H 0.236456 2.543734 0.295237
H -0.493343 -1.333488 -1.865406
H 1.378686 -1.090256 3.703681
H 1.991797 -0.481101 -5.325322
H 3.573467 -1.309790 -5.307311
H 3.469691 0.405362 -5.798720
H 1.673594 2.142309 5.082191
H -4.779076 1.140758 -2.680375
H 2.213919 3.842868 1.118796
H -0.935039 -0.302092 -4.107405
H 2.945390 3.642247 3.516020
H -3.081087 0.941778 -4.522648


