%chk=000240670.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240670

0 1
O -4.066727 -0.750008 0.937601
O -2.306621 1.578218 -0.130151
O -3.756624 -2.286560 -0.698207
O -1.148711 0.700244 1.611490
O 5.173434 0.970648 -0.178214
N 3.186220 0.411900 0.851285
C 0.316505 -0.834506 -1.140564
C 2.427456 0.009642 -0.290893
C 1.109876 -0.436786 -0.059347
C -1.056842 -1.321257 -0.925564
C 0.829009 -0.801462 -2.447942
C -1.992919 -0.727087 -0.163464
C 2.941278 0.051282 -1.599641
C 2.134951 -0.353102 -2.663770
C -3.333235 -1.358639 -0.045727
C -1.752076 0.544738 0.574648
C 4.525534 0.871343 0.843066
C -5.411889 -1.268973 1.209129
C -2.153595 2.934212 0.406467
C -5.314484 -2.541878 2.021162
C -0.769183 3.453568 0.082856
C 5.050403 1.216624 2.208106
H 0.703019 -0.471172 0.955362
H -1.307015 -2.256762 -1.457615
H 0.213023 -1.112058 -3.289427
H 3.965787 0.396682 -1.782875
H 2.533599 -0.319820 -3.679132
H 2.692733 0.358494 1.747198
H -5.842195 -0.419855 1.771803
H -5.932746 -1.412353 0.245869
H -2.361873 2.910326 1.490586
H -2.958384 3.459794 -0.139903
H -6.297635 -2.862327 2.385608
H -4.899433 -3.366814 1.422139
H -4.659227 -2.414598 2.893417
H -0.532609 3.331182 -0.983103
H 0.003349 2.910138 0.646334
H -0.671401 4.517769 0.326494
H 4.475309 2.016345 2.693947
H 6.090899 1.576467 2.126774
H 5.066942 0.351501 2.884898


%chk=000240670-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240670

0 1
O -4.088452 -0.682725 0.868160
O -2.517119 1.668128 0.354183
O -3.722854 -1.949576 -1.060141
O -0.885839 0.710298 1.713341
O 5.603895 0.555834 -0.366515
N 3.450328 0.545370 0.573263
C 0.463362 -0.948130 -1.103733
C 2.685177 -0.113292 -0.430697
C 1.303922 -0.286589 -0.168541
C -0.973273 -1.181317 -0.912917
C 1.047617 -1.461006 -2.302119
C -1.923433 -0.572763 -0.124456
C 3.251195 -0.597996 -1.642406
C 2.417290 -1.269987 -2.562924
C -3.309060 -1.135437 -0.196031
C -1.700249 0.619679 0.758160
C 4.817314 0.843110 0.582037
C -5.488025 -1.204653 0.936094
C -2.458540 2.924632 1.165995
C -5.529676 -2.555426 1.656283
C -1.383262 3.866611 0.617734
C 5.281030 1.550095 1.856287
H 0.881476 0.055762 0.782174
H -1.392098 -1.975205 -1.551315
H 0.415964 -1.990850 -3.024410
H 4.316419 -0.456547 -1.832554
H 2.852589 -1.654583 -3.491430
H 2.921368 0.832041 1.401337
H -6.027520 -0.421088 1.491708
H -5.881820 -1.284732 -0.092297
H -2.264163 2.653346 2.218307
H -3.470859 3.346001 1.060145
H -6.579920 -2.880949 1.775285
H -4.994258 -3.324724 1.075475
H -5.075080 -2.481079 2.659241
H -1.550731 4.072966 -0.453199
H -0.377373 3.431578 0.742378
H -1.415356 4.827365 1.164603
H 4.729961 2.495141 2.017996
H 6.352462 1.776380 1.760979
H 5.131497 0.909417 2.745220


