%chk=000193693.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193693

0 1
P 4.233326 -0.334137 -1.252870
O 0.160367 2.097452 -0.439503
O 2.097941 2.033416 2.577558
O 3.279847 0.903412 -0.809036
O 3.140944 -1.284450 -2.035315
O 4.399180 -1.223747 0.132894
O 5.493046 -0.005534 -1.920860
N -1.585294 0.671017 0.293601
N -3.275564 1.388173 -1.499216
N -3.021855 -0.888695 -0.651823
N -0.254708 -0.919250 1.731050
N -1.058268 -3.229241 1.573537
N -2.878576 -3.863699 0.200574
C -0.921808 1.966197 0.536492
C 1.446862 1.900780 0.222895
C -0.258026 2.059825 1.879590
C 1.075935 1.997390 1.699413
C -2.678765 0.399561 -0.659360
C -1.240687 -0.573737 0.838483
C 2.011360 0.535373 -0.178912
C -2.157030 -1.521960 0.261024
C -2.044735 -2.882890 0.666364
C -3.908482 2.500181 -0.737178
C -2.330488 1.860203 -2.553019
C -0.232193 -2.246098 2.042218
H -1.626016 2.799181 0.282580
H 2.092942 2.733855 -0.143368
H -0.824549 2.097466 2.788913
H 1.355801 0.041193 -0.928136
H 2.192002 -0.131735 0.689543
H 1.773358 1.971746 3.520951
H -3.196264 3.174836 -0.228671
H -4.600808 2.081988 0.014475
H -4.515452 3.097811 -1.439534
H -1.415359 2.348088 -2.175358
H -2.858520 2.559508 -3.220426
H -2.023036 0.992129 -3.164741
H 0.545625 -2.572740 2.754144
H -3.587145 -3.643886 -0.483600
H -2.760746 -4.821528 0.489335
H 3.476347 -2.061888 -2.544058
H 5.294788 -1.268761 0.545746


%chk=000193693-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000193693

0 1
P 4.064121 -0.372334 -1.826762
O 0.544704 2.084655 -0.203102
O 2.244320 1.869788 3.021587
O 3.162462 0.851851 -1.064598
O 3.004169 -1.700446 -1.608079
O 5.314530 -0.853613 -0.716700
O 4.579600 0.007060 -3.271730
N -1.395550 0.679616 0.335198
N -3.006046 1.776120 -1.173323
N -3.180552 -0.549537 -0.472663
N -0.251712 -1.141850 1.624926
N -1.499515 -3.261331 1.537768
N -3.522427 -3.501497 0.331928
C -0.640027 1.892587 0.686630
C 1.781621 1.908797 0.594378
C -0.075978 1.894731 2.087654
C 1.277823 1.908052 2.027039
C -2.559805 0.652145 -0.490095
C -1.249920 -0.626598 0.849543
C 2.518797 0.608434 0.259181
C -2.376510 -1.342765 0.365228
C -2.479123 -2.710558 0.742461
C -4.414698 1.740733 -1.617135
C -2.095408 2.484872 -2.112537
C -0.461820 -2.462303 1.925058
H -1.324015 2.735689 0.480186
H 2.438009 2.769298 0.368947
H -0.706972 1.836211 2.975080
H 1.823112 -0.244015 0.199280
H 3.302097 0.411066 1.014742
H 1.839881 1.736728 3.914601
H -4.734478 2.771066 -1.853316
H -5.049278 1.335542 -0.814454
H -4.551445 1.104918 -2.516544
H -2.333424 3.563436 -2.119460
H -2.218615 2.089350 -3.143306
H -1.041036 2.357311 -1.824858
H 0.301266 -2.940851 2.546532
H -4.241809 -3.113445 -0.273708
H -3.544483 -4.477557 0.617825
H 3.377353 -2.592194 -1.818426
H 6.196074 -0.442356 -0.908580


