%chk=000241322.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241322

0 1
Cl 8.750323 1.634309 0.015551
Cl -8.750260 1.634449 0.014052
O 0.000024 0.844087 0.006620
N 2.375176 -0.519025 -0.002322
N -2.375146 -0.518985 -0.002693
N 1.179465 -1.183877 -0.007876
N -1.179446 -1.183861 -0.007609
C 4.769640 -0.474849 -0.000728
C -4.769607 -0.474761 -0.002697
C 5.964478 -1.219291 -0.002437
C -5.964460 -1.219160 -0.008569
C 4.823326 0.931170 0.006130
C -4.823269 0.931230 0.008399
C 7.199827 -0.569687 0.002608
C -7.199798 -0.569539 -0.003411
C 6.054614 1.589135 0.011211
C -6.054550 1.589213 0.013613
C 7.225059 0.827332 0.009365
C -7.225007 0.827455 0.007614
C 3.486484 -1.204939 -0.006310
C -3.486464 -1.204869 -0.008454
C 0.000016 -0.354480 -0.001905
H 5.934415 -2.308234 -0.007647
H -5.934413 -2.308081 -0.017211
H 3.894641 1.511873 0.007584
H -3.894574 1.511902 0.012920
H 8.128005 -1.140714 0.001337
H -8.127989 -1.140529 -0.007922
H 6.100291 2.678727 0.016549
H -6.100205 2.678786 0.022212
H 3.570718 -2.301519 -0.013636
H -3.570715 -2.301436 -0.017441
H 1.128026 -2.206135 -0.013876
H -1.128024 -2.206098 -0.016522


%chk=000241322-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241322

0 1
Cl 9.122972 1.254493 0.011185
Cl -9.122910 1.254643 0.010721
O 0.000026 1.207045 0.007780
N 2.402189 -0.255621 -0.000318
N -2.402156 -0.255583 -0.001232
N 1.163353 -0.854004 -0.003796
N -1.163329 -0.853979 -0.005420
C 4.814936 -0.465351 -0.000283
C -4.814905 -0.465265 -0.002883
C 5.940549 -1.333867 -0.004563
C -5.940535 -1.333744 -0.009685
C 5.030231 0.943538 0.007560
C -5.030175 0.943608 0.008124
C 7.254285 -0.819067 -0.001149
C -7.254262 -0.818923 -0.005652
C 6.335301 1.468853 0.011060
C -6.335234 1.468942 0.012281
C 7.430930 0.577702 0.006654
C -7.430880 0.577827 0.005335
C 3.463439 -1.035981 -0.003869
C -3.463418 -1.035913 -0.007147
C 0.000018 -0.037451 0.000272
H 5.792735 -2.420768 -0.010576
H -5.792741 -2.420631 -0.018155
H 4.161344 1.608905 0.010852
H -4.161275 1.608946 0.013325
H 8.119825 -1.487284 -0.004446
H -8.119814 -1.487112 -0.010888
H 6.503066 2.549649 0.017115
H -6.502980 2.549725 0.020768
H 3.388823 -2.143660 -0.009519
H -3.388820 -2.143576 -0.015400
H 1.079388 -1.883268 -0.008747
H -1.079377 -1.883230 -0.012804


