%chk=000298414.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298414

0 1
Cl 5.532663 -0.981929 -0.809499
O -2.707578 2.341024 0.202708
N -2.065879 -1.182896 -0.415688
N 0.769584 -0.137636 0.365813
N 2.323907 -1.634689 -0.433455
N 2.301586 1.819859 0.731850
N 4.612610 1.299152 0.125101
C -4.126399 0.402834 -0.158467
C -1.595895 0.242493 -0.308077
C -4.154640 -0.305831 -1.527764
C -4.110199 -0.647025 0.972243
C -2.957703 -1.282532 -1.623531
C -2.868014 -1.552979 0.801135
C -2.805755 1.169929 -0.051983
C -0.527638 0.417732 0.787175
C 1.992001 0.537580 0.355760
C 1.031519 -1.452994 -0.130849
C 2.962527 -0.420172 -0.145258
C 4.294788 0.041285 -0.237514
C 3.609085 2.132900 0.592508
H -4.990745 1.093287 -0.049999
H -1.145174 0.535798 -1.297689
H -4.124644 0.436057 -2.346076
H -5.110266 -0.847201 -1.649605
H -5.038968 -1.245050 0.939872
H -4.106818 -0.152277 1.960038
H -3.306072 -2.332586 -1.709555
H -2.348348 -1.084491 -2.529220
H -2.207359 -1.495339 1.691268
H -3.162833 -2.618443 0.702760
H -0.842068 -0.075905 1.738084
H -0.402541 1.512613 1.011538
H 0.232413 -2.183891 -0.242727
H 3.926950 3.151224 0.875203


%chk=000298414-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298414

0 1
Cl 5.631226 -1.062516 -0.774494
O -2.734790 2.353060 0.456543
N -2.071471 -1.165829 -0.391843
N 0.790107 -0.138898 0.360693
N 2.342753 -1.687802 -0.350293
N 2.275662 1.824462 0.627409
N 4.597141 1.308098 0.059369
C -4.144096 0.411693 -0.150834
C -1.612709 0.255261 -0.244864
C -4.132074 -0.265977 -1.555559
C -4.187539 -0.709146 0.939518
C -2.918346 -1.264543 -1.626293
C -2.893671 -1.588974 0.789537
C -2.834628 1.166759 0.057222
C -0.488305 0.451359 0.792129
C 2.015040 0.529137 0.320241
C 1.049981 -1.459351 -0.048933
C 2.971175 -0.452628 -0.125325
C 4.292551 0.033300 -0.233040
C 3.590391 2.148770 0.473181
H -4.994492 1.104654 -0.042584
H -1.207938 0.569838 -1.229592
H -4.065875 0.500208 -2.348972
H -5.091212 -0.797851 -1.696843
H -5.103470 -1.309313 0.784224
H -4.255224 -0.260605 1.946572
H -3.262857 -2.309810 -1.711684
H -2.278251 -1.055420 -2.501419
H -2.267168 -1.531706 1.696652
H -3.150725 -2.652608 0.646507
H -0.778488 0.026694 1.770610
H -0.320126 1.533044 0.933132
H 0.240582 -2.180698 -0.134065
H 3.880943 3.177236 0.699197


