%chk=000249629.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249629

0 1
O -1.639507 0.501520 -0.599083
O 1.710770 -0.363293 0.721086
O -3.252638 -0.209144 0.889896
O 3.493973 0.643920 -0.314316
O 0.423694 -0.134235 -2.057687
N -0.738588 -3.106400 -0.366890
C -0.542189 -1.628270 -0.349851
C 0.659535 -1.302549 -1.284501
C -1.816095 -0.914638 -0.862852
C 1.964263 -1.160384 -0.460113
C -3.106416 -1.253039 -0.097735
C -2.321062 0.872793 0.630493
C 3.081998 -0.411416 -1.210626
C 2.448343 0.892241 0.650599
C -1.338915 0.930620 1.786562
C -3.095490 2.142650 0.346003
C 1.529998 2.000843 0.161485
C 3.103581 1.118596 1.996440
H -0.321517 -1.219495 0.681720
H 0.782705 -2.084823 -2.075012
H -1.910823 -0.977949 -1.968702
H 2.288512 -2.144045 -0.060556
H -4.004605 -1.215684 -0.737466
H -3.089688 -2.193489 0.474392
H 3.991647 -1.005264 -1.383956
H 2.731606 0.061211 -2.148550
H -1.531609 -3.370393 0.214641
H 0.075469 -3.574559 0.024427
H -0.465372 0.277179 1.597239
H -0.958082 1.940742 1.962084
H -1.813125 0.582224 2.714199
H -3.637311 2.484066 1.236466
H -2.435192 2.948821 0.005852
H -3.839913 1.975077 -0.445571
H 1.134201 2.608613 0.980654
H 0.660899 1.590932 -0.387249
H 2.066759 2.669893 -0.525680
H 3.618097 2.086519 2.033131
H 3.856586 0.341568 2.195213
H 2.368479 1.078687 2.808848
H 0.163021 0.637252 -1.463434


%chk=000249629-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249629

0 1
O -2.263650 0.374188 -0.882413
O 2.238073 -0.788134 0.680945
O -3.094263 0.052170 1.305463
O 4.036832 0.224402 -0.427950
O 0.345851 0.844307 -1.241157
N -0.251720 -2.609081 0.282323
C -0.477581 -1.187997 -0.046944
C 0.501066 -0.608178 -1.120470
C -1.961388 -1.036332 -0.470922
C 1.970245 -0.937851 -0.774985
C -2.943580 -1.284772 0.691371
C -3.103310 1.020531 0.200009
C 3.014160 -0.015041 -1.467773
C 3.312374 0.241108 0.856233
C -2.419118 2.298073 0.682531
C -4.512759 1.230732 -0.368787
C 2.673202 1.612259 1.128230
C 4.267296 -0.240490 1.943614
H -0.316786 -0.603980 0.876955
H 0.278646 -1.092428 -2.104884
H -2.178765 -1.674158 -1.349246
H 2.157836 -2.001763 -1.014117
H -3.919433 -1.666476 0.333028
H -2.519707 -1.958218 1.449277
H 3.531573 -0.501240 -2.309473
H 2.543754 0.929289 -1.790941
H 0.562653 -2.743849 0.890771
H -0.235631 -3.236719 -0.529788
H -1.396761 2.073644 1.027783
H -2.372587 3.041506 -0.131601
H -2.989216 2.731242 1.522016
H -5.154098 1.725237 0.381264
H -4.466323 1.862060 -1.272382
H -4.969640 0.265221 -0.644838
H 2.159081 1.598666 2.105687
H 1.930787 1.850646 0.347761
H 3.454717 2.392087 1.149058
H 5.084958 0.488069 2.078868
H 4.696818 -1.213412 1.656171
H 3.728663 -0.350392 2.899975
H -0.646271 1.011975 -1.229063


