%chk=000242183.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242183

0 1
P 0.345666 -2.748225 0.754234
O 1.167693 -1.286144 0.199793
O -1.274692 -2.134154 0.504086
O 0.730096 -4.128510 0.080614
N 0.300035 -2.607962 2.531608
N 3.065795 -0.371061 -0.837424
N -3.118843 -1.504745 -0.814281
N 3.390484 -1.922417 0.858330
N -1.108512 -1.988767 -1.894253
C 0.331958 -3.947736 3.283776
C 1.551148 -3.057165 3.293201
C 2.550719 -1.240319 0.112751
C -1.772489 -1.881616 -0.771261
C 4.530476 -0.297440 -0.610742
C -3.384177 -1.095132 -2.223464
C 4.755557 -1.513015 0.365020
C -2.114216 -1.654971 -2.963821
C 2.297454 0.562193 -1.664253
C -3.840358 -0.908426 0.324319
C 2.225501 1.982862 -1.095651
C -3.742342 0.618901 0.394159
C 1.675860 2.213767 0.191951
C -2.478094 1.263663 0.425897
C 2.702915 3.085130 -1.844503
C -4.914775 1.412333 0.417775
C 1.610617 3.521735 0.718515
C -2.392233 2.671338 0.475726
C 2.635289 4.397579 -1.321280
C -4.832856 2.823050 0.479571
C 2.090962 4.618816 -0.036553
C -3.569983 3.455755 0.505136
H 0.378285 -4.861589 2.679752
H -0.347242 -3.968615 4.140428
H 1.753924 -2.417843 4.157625
H 2.429269 -3.331535 2.700025
H 5.080350 -0.407155 -1.562746
H 4.810204 0.672995 -0.152000
H -4.323655 -1.540976 -2.593924
H -3.460783 0.009192 -2.293803
H 5.398066 -1.246294 1.220591
H 5.218689 -2.369942 -0.159600
H -1.685162 -0.927458 -3.672988
H -2.352756 -2.578190 -3.524914
H 2.742787 0.589369 -2.677942
H 1.283534 0.130835 -1.763025
H -4.903676 -1.208531 0.266425
H -3.414917 -1.365885 1.236109
H 1.299999 1.365241 0.777323
H -1.561306 0.662336 0.416776
H 3.131702 2.917789 -2.840565
H -5.897673 0.925352 0.385668
H 1.190979 3.686856 1.717526
H -1.409389 3.155118 0.485465
H 3.009141 5.241478 -1.911733
H -5.749227 3.423507 0.499607
H 2.040795 5.633519 0.373510
H -3.501492 4.548613 0.544436


%chk=000242183-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242183

0 1
P 0.262466 -2.697542 0.426463
O 1.196704 -1.194717 0.691622
O -1.279815 -1.900192 0.188234
O 0.811069 -3.659118 -0.698968
N -0.146933 -3.420342 1.966964
N 3.246435 -0.450405 -0.243579
N -2.883959 -0.811555 -1.136098
N 3.304469 -1.938185 1.540446
N -0.660450 -0.671296 -1.791793
C 0.932821 -3.683389 3.006939
C -0.126456 -2.621972 3.254190
C 2.588542 -1.239884 0.686140
C -1.543320 -1.124164 -0.934944
C 4.703674 -0.681203 -0.069935
C -2.942824 0.155922 -2.261347
C 4.736623 -1.632816 1.190171
C -1.471047 0.077029 -2.818917
C 2.656064 0.122459 -1.455929
C -3.975621 -1.036622 -0.185057
C 2.904352 1.622377 -1.603065
C -4.370011 0.205542 0.620913
C 2.907552 2.475924 -0.471174
C -3.380222 0.986149 1.272052
C 3.091490 2.191367 -2.887069
C -5.729408 0.581347 0.744657
C 3.091150 3.868491 -0.620340
C -3.746011 2.116245 2.035140
C 3.270047 3.585486 -3.040740
C -6.099572 1.710476 1.512189
C 3.271232 4.429799 -1.906588
C -5.107876 2.481654 2.159568
H 1.948951 -3.325423 2.781740
H 0.839528 -4.665182 3.479040
H -0.980590 -2.830033 3.904937
H 0.193599 -1.574876 3.200490
H 5.121114 -1.162431 -0.977417
H 5.242056 0.269003 0.095938
H -3.699273 -0.149490 -3.006445
H -3.201168 1.168498 -1.891476
H 5.221368 -1.142527 2.053677
H 5.278687 -2.572575 0.986543
H -1.035236 1.077015 -2.982584
H -1.432486 -0.475928 -3.775685
H 3.055373 -0.407268 -2.347805
H 1.565900 -0.087477 -1.430806
H -4.859962 -1.419884 -0.730634
H -3.637107 -1.839276 0.495388
H 2.767251 2.038105 0.524266
H -2.323868 0.705315 1.182523
H 3.099418 1.540157 -3.770652
H -6.502984 -0.011356 0.239651
H 3.092627 4.516637 0.263874
H -2.972179 2.711268 2.533382
H 3.415262 4.010472 -4.040678
H -7.155812 1.989208 1.600055
H 3.414720 5.510046 -2.022758
H -5.391252 3.358641 2.752296


