%chk=000242177.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242177

0 1
Cl 0.739546 2.770383 -0.328219
N 1.566130 -0.129926 -0.035485
N -0.684693 -0.930796 0.132502
N -1.644099 1.734717 -0.137571
C 4.511557 -1.298822 0.060698
C 4.854387 0.178652 0.306215
C 3.401079 -1.524000 -0.971932
C 3.651958 1.130414 0.362970
C 1.989138 -1.529584 -0.364318
C 2.405823 0.522232 1.022856
C 0.174683 0.098237 0.044167
C -0.353896 1.464764 -0.108690
C -2.049108 -0.669947 0.074895
C -2.535948 0.668605 -0.037511
C -2.981368 -1.750270 0.152013
C -3.942137 0.914926 -0.065688
C -4.328512 -1.482056 0.122626
C -4.812376 -0.145215 0.013821
H 5.430023 -1.822237 -0.273005
H 4.233653 -1.780082 1.018998
H 5.429428 0.253669 1.250485
H 5.541171 0.530869 -0.489608
H 3.461671 -0.755426 -1.769391
H 3.560662 -2.496251 -1.479067
H 3.938682 2.051396 0.906562
H 3.389384 1.464659 -0.664309
H 1.271568 -1.949527 -1.108035
H 1.938709 -2.193706 0.525644
H 2.694755 -0.219860 1.801066
H 1.831639 1.305626 1.559739
H -2.593713 -2.766265 0.235400
H -4.288432 1.946497 -0.151528
H -5.054308 -2.294063 0.182010
H -5.889357 0.019588 -0.006008


%chk=000242177-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242177

0 1
Cl 0.713667 2.953346 -0.171643
N 1.536410 -0.190971 0.215425
N -0.696775 -0.919383 -0.006447
N -1.661466 1.725729 0.090519
C 4.564232 -1.301888 0.049234
C 4.903661 0.211480 0.128241
C 3.334080 -1.662276 -0.822085
C 3.684277 1.169591 0.244965
C 1.969407 -1.575669 -0.097785
C 2.477088 0.616394 1.040133
C 0.183930 0.109185 0.117843
C -0.378583 1.466642 0.081659
C -2.054887 -0.672918 -0.057602
C -2.570322 0.673112 0.065043
C -2.980919 -1.753582 -0.186808
C -3.972002 0.915533 0.090225
C -4.357287 -1.497359 -0.160752
C -4.857710 -0.164253 -0.017028
H 5.456383 -1.833986 -0.335243
H 4.393807 -1.702915 1.069823
H 5.580606 0.366366 0.992041
H 5.483500 0.501547 -0.770211
H 3.310592 -1.042581 -1.739552
H 3.432572 -2.714814 -1.155294
H 4.017108 2.111059 0.723322
H 3.313668 1.452224 -0.756514
H 1.177549 -2.029531 -0.713088
H 2.019621 -2.169910 0.841958
H 2.828199 -0.028579 1.873745
H 1.918674 1.446650 1.495980
H -2.584773 -2.768859 -0.284663
H -4.322324 1.947954 0.184117
H -5.065442 -2.328821 -0.248981
H -5.938841 0.008682 0.001724


