%chk=000207448.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207448

0 1
O 0.317680 0.693566 0.031343
O -4.895909 1.106437 -1.137310
O -1.362021 -1.385311 0.423385
N -3.151147 -0.165121 -0.375798
N -1.054574 0.930121 0.271654
C -1.420398 2.066567 -0.630815
C -2.919641 2.317067 -0.504244
C -3.990598 -1.407570 -0.432613
C -3.759731 1.077927 -0.717148
C -1.803869 -0.308110 0.090530
C -4.642433 -1.691139 0.928803
C 0.988661 0.340526 1.302242
C 2.425159 0.240990 0.880052
C -5.512276 -2.941862 0.859366
C 4.160909 -0.910771 -0.380890
C 2.823874 -0.789835 0.017525
C 5.115173 0.016706 0.096170
C 3.368656 1.166060 1.343225
C 4.704775 1.046271 0.955047
C 4.560515 -2.018141 -1.302293
C 6.551651 -0.086827 -0.304019
H -1.124871 1.873861 -1.687172
H -0.834871 2.954826 -0.295518
H -3.241819 3.102376 -1.223821
H -3.164007 2.729443 0.503109
H -3.340430 -2.257806 -0.740865
H -4.766637 -1.266730 -1.220437
H -3.857138 -1.817068 1.702176
H -5.252353 -0.822035 1.246072
H 0.573105 -0.625523 1.650537
H 0.789703 1.127812 2.046244
H -4.928623 -3.828419 0.583821
H -5.978364 -3.149382 1.830132
H -6.321189 -2.835221 0.126726
H 2.076931 -1.496748 -0.347729
H 3.067854 1.976409 2.003895
H 5.434628 1.765159 1.323992
H 5.312280 -2.671986 -0.837891
H 3.712992 -2.655449 -1.587896
H 4.995262 -1.625675 -2.232495
H 7.173902 0.698519 0.143705
H 6.981288 -1.051885 0.001081
H 6.667599 -0.007832 -1.394575


%chk=000207448-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207448

0 1
O 0.312070 1.056672 -0.266384
O -5.210726 1.122543 -0.562105
O -1.192414 -1.233628 -0.038505
N -3.199131 -0.051786 -0.398014
N -1.132446 1.113505 -0.084025
C -1.719320 2.336388 -0.659196
C -3.175905 2.431059 -0.180017
C -3.924907 -1.349342 -0.510239
C -3.957917 1.140241 -0.410768
C -1.779557 -0.126368 -0.178895
C -4.388905 -1.887456 0.860729
C 0.985060 0.780353 1.062294
C 2.427916 0.486017 0.747182
C -5.154040 -3.218648 0.704568
C 4.104792 -1.031321 -0.251790
C 2.765601 -0.710495 0.065099
C 5.146923 -0.129083 0.133498
C 3.460160 1.377211 1.118127
C 4.803636 1.063419 0.815597
C 4.428150 -2.319064 -0.988265
C 6.598897 -0.439197 -0.182339
H -1.660855 2.316007 -1.767248
H -1.129310 3.195281 -0.301353
H -3.709908 3.243278 -0.699207
H -3.205297 2.653039 0.904352
H -3.242983 -2.070094 -0.990366
H -4.797514 -1.171248 -1.161328
H -3.503886 -2.033748 1.507670
H -5.039994 -1.134295 1.343253
H 0.473107 -0.091222 1.506126
H 0.866382 1.669219 1.710047
H -4.517015 -3.993005 0.237383
H -5.484492 -3.602248 1.686401
H -6.052987 -3.090102 0.072959
H 1.958158 -1.392484 -0.228176
H 3.218710 2.310637 1.641188
H 5.601271 1.755535 1.111227
H 5.107519 -2.966540 -0.400533
H 3.512726 -2.895768 -1.201943
H 4.935412 -2.120080 -1.952247
H 7.267477 0.356351 0.188204
H 6.920538 -1.394067 0.276669
H 6.764701 -0.541268 -1.272327


