%chk=000202442.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202442

0 1
O -1.594628 0.261173 1.582105
O 1.251093 -0.667604 -1.774895
O 0.305652 4.109632 3.800341
O -0.846332 4.913121 2.059799
N 1.367218 0.634089 0.086495
N -1.185708 -1.039364 -0.246257
C -0.015837 1.130371 -0.084816
C -0.185129 2.532270 0.519584
C -0.026273 2.590787 2.039451
C -1.012063 0.100536 0.518419
C -2.173289 -2.073358 0.145106
C 1.923440 -0.254277 -0.839835
C -3.507582 -1.813068 -0.515430
C -0.265928 3.974568 2.550838
C 3.342937 -0.639466 -0.577348
C -4.327034 -0.782499 -0.030196
C -3.928802 -2.589298 -1.602523
C 3.668744 -2.001724 -0.525407
C 4.337582 0.335544 -0.423260
C -5.564088 -0.535800 -0.628801
C -5.169827 -2.338833 -2.197176
C -5.987869 -1.314306 -1.712004
C 4.993109 -2.386920 -0.299305
C 5.660405 -0.057158 -0.202851
C 5.987161 -1.416285 -0.136964
H -0.226499 1.207571 -1.195292
H -1.196797 2.915629 0.248007
H 0.531378 3.228378 0.033720
H 0.961564 2.219139 2.378001
H -0.769391 1.890010 2.522598
H 1.860520 0.913389 0.929019
H -0.711214 -1.161989 -1.148933
H -1.767958 -3.073269 -0.127183
H -2.293008 -2.067563 1.259054
H -3.988171 -0.175322 0.813469
H -3.295953 -3.385735 -1.988282
H 2.891202 -2.753978 -0.669532
H 4.086786 1.394227 -0.488063
H -6.199734 0.263687 -0.251246
H -5.497534 -2.943456 -3.041007
H -6.953018 -1.121362 -2.176133
H 5.250634 -3.444759 -0.255174
H 6.438380 0.696467 -0.085536
H 7.019839 -1.719155 0.037022
H 0.144819 5.004262 4.201422


%chk=000202442-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000202442

0 1
O -1.819868 0.661762 1.741157
O 1.000744 -0.707732 -1.625030
O 0.745224 4.337836 3.964716
O -0.440684 5.183846 2.156875
N 1.289648 0.703054 0.192523
N -1.342121 -0.794101 -0.022652
C -0.062880 1.298377 0.083814
C -0.097807 2.720791 0.677458
C 0.241570 2.802306 2.181576
C -1.158111 0.361960 0.694159
C -2.312200 -1.830124 0.383104
C 1.763874 -0.224232 -0.714441
C -3.567056 -1.851391 -0.486423
C 0.127494 4.215643 2.708275
C 3.197704 -0.650617 -0.580575
C -4.460429 -0.748589 -0.470501
C -3.863441 -2.964011 -1.310309
C 3.579488 -1.867263 -1.202229
C 4.174080 0.111278 0.115065
C -5.625384 -0.760504 -1.267144
C -5.030757 -2.978609 -2.109532
C -5.914395 -1.876150 -2.089872
C 4.908414 -2.328619 -1.110231
C 5.504857 -0.351112 0.204967
C 5.873728 -1.574519 -0.401540
H -0.276277 1.362496 -1.000996
H -1.113046 3.128614 0.532672
H 0.589841 3.363105 0.095924
H 1.256947 2.437211 2.429701
H -0.473446 2.164615 2.737381
H 1.860439 0.956391 1.000046
H -0.743722 -0.935770 -0.856247
H -1.810867 -2.815074 0.348950
H -2.578236 -1.611159 1.433179
H -4.239142 0.110905 0.173707
H -3.179123 -3.821921 -1.328612
H 2.817898 -2.426230 -1.755257
H 3.921436 1.084000 0.554634
H -6.310613 0.094515 -1.244767
H -5.248394 -3.845476 -2.743742
H -6.819585 -1.885061 -2.707557
H 5.193310 -3.271476 -1.589187
H 6.254226 0.245462 0.736159
H 6.907015 -1.931491 -0.330505
H 0.612443 5.265366 4.302305


