%chk=000251978.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251978

0 1
Cl 2.745574 3.105263 -0.262630
F -5.771260 -0.634225 0.120889
O -0.827875 -2.639141 -0.681717
O 4.014383 -1.954786 0.412228
N 3.794546 0.307064 -0.007552
C -0.911748 -1.613787 0.295697
C 0.176098 -0.550997 0.149327
C -0.418556 0.742078 0.021091
C -2.193999 -0.790948 0.181796
C -1.880396 0.596086 0.041281
C 1.540868 -0.725669 0.143608
C 0.380843 1.864852 -0.105017
C -3.501448 -1.232423 0.209166
C -2.886599 1.546431 -0.060895
C 2.376040 0.417281 0.011621
C 1.773901 1.686687 -0.107065
C -4.496576 -0.240502 0.098488
C -4.226980 1.120535 -0.031278
C 4.540730 -0.883908 0.200094
C 6.025757 -0.672511 0.127810
H -0.840960 -2.173021 1.257800
H 1.980408 -1.729264 0.238220
H -0.046514 2.863009 -0.199922
H -3.750270 -2.289012 0.305712
H -2.652601 2.604596 -0.163295
H -5.033784 1.848773 -0.109879
H -0.846827 -2.260064 -1.589787
H 4.317983 1.173178 -0.171097
H 6.354211 -0.300233 -0.852361
H 6.546322 -1.632488 0.293426
H 6.393229 0.022245 0.895641


%chk=000251978-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251978

0 1
Cl 2.892215 3.113727 -0.244366
F -5.902402 -0.616748 0.053902
O -0.866128 -2.757180 -0.605898
O 4.137454 -2.056476 0.284067
N 3.811189 0.256981 0.025968
C -0.954390 -1.619278 0.323524
C 0.150992 -0.569056 0.175415
C -0.423851 0.728511 0.045381
C -2.226651 -0.777271 0.185783
C -1.895779 0.604883 0.050665
C 1.534922 -0.773262 0.174834
C 0.411577 1.856905 -0.079843
C -3.560144 -1.212226 0.189406
C -2.913424 1.575212 -0.069095
C 2.400510 0.355552 0.041481
C 1.799530 1.643597 -0.078302
C -4.550005 -0.216908 0.058455
C -4.264912 1.156542 -0.064809
C 4.607007 -0.891369 0.144366
C 6.105262 -0.600976 0.086872
H -0.906503 -2.111370 1.312573
H 1.977387 -1.767049 0.268188
H 0.013260 2.870450 -0.176910
H -3.831935 -2.267424 0.280517
H -2.676508 2.639662 -0.167392
H -5.087716 1.870969 -0.157869
H -0.860245 -2.407992 -1.534314
H 4.303203 1.150343 -0.080987
H 6.385559 -0.123622 -0.870237
H 6.649539 -1.551093 0.181786
H 6.415487 0.071062 0.908238


