%chk=000212503.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212503

0 1
O -1.539685 1.697899 -1.640734
O -1.766957 -3.564860 1.101356
O 1.011522 1.533328 -1.926756
O 0.570116 -0.828233 -0.756353
N -2.393157 1.883481 0.466719
N -1.506308 -1.306511 0.937357
C -3.515880 -0.285988 -0.152240
C -3.667315 1.224293 0.079923
C -2.965000 -1.058406 1.054654
C -1.368616 2.025262 -0.455961
C -1.030883 -2.619184 0.847805
C -0.063595 2.554620 0.002372
C 0.417516 -2.800795 0.540249
C 1.077227 2.264229 -0.779670
C 1.193472 -1.939682 -0.258876
C 0.111076 3.336530 1.159206
C 1.041295 -3.953864 1.050321
C 2.367581 2.682509 -0.393332
C 2.546367 -2.198353 -0.541048
C 1.375858 3.769200 1.539170
C 2.384617 -4.221825 0.788085
C 2.503626 3.432725 0.765680
C 3.133026 -3.344415 -0.008078
H -4.502725 -0.702122 -0.438707
H -2.871723 -0.454094 -1.046191
H -4.415614 1.432632 0.874991
H -4.038147 1.700357 -0.861395
H -3.147871 -0.510721 2.004780
H -3.491835 -2.041747 1.155502
H -2.211664 1.970589 1.461864
H -0.945896 -0.532081 0.578419
H -0.756253 3.614131 1.760358
H 0.443436 -4.645498 1.655400
H 3.220689 2.424917 -1.018159
H 3.118884 -1.518614 -1.164580
H 1.501626 4.372516 2.436154
H 2.849467 -5.116635 1.196167
H 3.492202 3.773259 1.080604
H 4.182273 -3.560493 -0.214818
H 0.021105 1.458361 -2.281370
H 1.167345 -0.264917 -1.346467


%chk=000212503-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212503

0 1
O -1.729173 1.959024 -1.323158
O -1.322169 -1.212627 2.125149
O 0.651615 1.541577 -2.062616
O 0.256240 -1.172827 -1.768625
N -2.266738 1.324962 0.848144
N -1.854967 -1.603756 -0.110730
C -3.904094 -0.136981 -0.438414
C -3.680935 1.080304 0.493490
C -3.309954 -1.475394 0.072427
C -1.367387 1.740135 -0.090962
C -0.956577 -1.506097 0.927359
C 0.062068 1.904477 0.296363
C 0.488339 -1.780644 0.597247
C 1.045127 1.808604 -0.739327
C 1.069757 -1.594460 -0.691052
C 0.492060 2.152227 1.624942
C 1.326454 -2.209238 1.658758
C 2.417913 1.932535 -0.443266
C 2.443279 -1.849918 -0.905055
C 1.861765 2.287707 1.922751
C 2.695008 -2.469723 1.449790
C 2.821616 2.171934 0.885991
C 3.254583 -2.289593 0.161774
H -4.998739 -0.265417 -0.554417
H -3.496701 0.096829 -1.438081
H -4.230806 0.942143 1.441584
H -4.069696 1.985478 -0.005653
H -3.516077 -1.609330 1.149387
H -3.794261 -2.308843 -0.471460
H -1.908351 0.841606 1.684041
H -1.453547 -1.657744 -1.059396
H -0.250776 2.255595 2.423750
H 0.870902 -2.316539 2.648653
H 3.143057 1.845294 -1.257604
H 2.856888 -1.708966 -1.909472
H 2.182718 2.482280 2.950725
H 3.322222 -2.808313 2.280968
H 3.887934 2.275320 1.114514
H 4.317089 -2.492859 -0.012496
H -0.363794 1.793642 -2.094561
H 0.539308 -0.270604 -2.129062


