%chk=000214585.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214585

0 1
O 1.841256 -1.728855 -0.949991
O -3.517056 1.095214 0.096596
O 3.432716 0.082837 -0.138107
O 2.682989 2.215927 0.020499
N -0.405603 -1.426698 -0.698801
N -1.270852 0.780799 0.024270
C -1.524746 -0.710320 -0.031603
C -0.643254 -2.906466 -0.830340
C -1.749998 -1.254056 1.396536
C -0.950445 -3.514342 0.556874
C -2.045315 -2.757750 1.318245
C -1.750837 -3.171062 -1.851403
C 0.944368 -0.981336 -0.613424
C 0.041311 1.248863 0.023057
C 1.106472 0.432561 -0.212336
C -2.438354 1.640224 0.061223
C -2.193505 3.128501 0.033838
C 2.451000 1.025495 -0.103363
C -3.497476 3.892353 0.231079
C 4.821822 0.543492 -0.048673
C 5.157283 0.906511 1.382642
H -2.454067 -0.864320 -0.658776
H 0.318016 -3.355310 -1.217592
H -2.594848 -0.721612 1.874998
H -0.863781 -1.068299 2.031986
H -0.017599 -3.521368 1.156648
H -1.238340 -4.575593 0.437451
H -3.027750 -2.923738 0.833177
H -2.141489 -3.169931 2.341545
H -1.800447 -4.237259 -2.100864
H -2.741450 -2.872817 -1.492149
H -1.562477 -2.625493 -2.786188
H 0.203424 2.323212 0.228963
H -1.461901 3.428828 0.815832
H -1.733970 3.413679 -0.940286
H -3.338552 4.974709 0.153977
H -3.944211 3.687749 1.213596
H -4.249652 3.609148 -0.519878
H 5.348173 -0.361262 -0.407618
H 4.959930 1.386447 -0.747702
H 6.228869 1.099217 1.506859
H 4.617295 1.812267 1.697558
H 4.877749 0.102653 2.075945


%chk=000214585-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214585

0 1
O 1.801880 -1.840040 -1.111525
O -3.555322 1.082145 0.154602
O 3.507166 0.118307 -0.108661
O 2.600830 2.264651 -0.067883
N -0.459404 -1.462624 -0.679990
N -1.266957 0.734586 0.007217
C -1.525015 -0.733204 0.037600
C -0.764053 -2.914336 -0.882110
C -1.685287 -1.286197 1.476360
C -0.976588 -3.562249 0.518507
C -2.012965 -2.799708 1.384329
C -1.937800 -3.130745 -1.860436
C 0.893345 -1.062584 -0.688099
C 0.043278 1.182129 -0.023845
C 1.118424 0.353509 -0.262248
C -2.402882 1.592187 0.082383
C -2.149737 3.100091 0.065004
C 2.452174 1.010879 -0.152926
C -3.463212 3.902464 0.074487
C 4.874874 0.712013 0.015988
C 5.230704 0.943130 1.487744
H -2.480369 -0.884925 -0.494657
H 0.153178 -3.332357 -1.331765
H -2.498723 -0.744798 1.991698
H -0.744397 -1.124760 2.037886
H 0.000242 -3.572403 1.040067
H -1.290108 -4.616027 0.391605
H -3.028918 -2.922765 0.958562
H -2.045150 -3.236905 2.399448
H -2.030292 -4.208173 -2.086702
H -2.911310 -2.794259 -1.459554
H -1.750875 -2.596371 -2.808029
H 0.230119 2.243823 0.155814
H -1.532941 3.374256 0.945235
H -1.545800 3.361979 -0.825856
H -3.245215 4.984796 0.077840
H -4.068920 3.660761 0.963597
H -4.075347 3.669455 -0.812788
H 5.521313 -0.046884 -0.452230
H 4.907082 1.654457 -0.558058
H 6.280567 1.281697 1.568248
H 4.583010 1.718122 1.930566
H 5.124101 0.009674 2.066879


