%chk=000216610.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216610

0 1
Cl 4.619657 -3.571841 -1.141141
O 2.866431 0.218360 1.612848
N 0.141239 1.424882 -0.499285
N -2.396189 0.057552 -0.187436
C 1.588541 1.654770 -0.825221
C -0.616755 0.914379 -1.691097
C -0.103328 0.500157 0.651835
C 2.145249 2.819411 0.023594
C -2.125382 0.934014 -1.368924
C -1.604482 0.511934 0.998876
C 2.433503 0.393067 -0.825130
C 2.246381 2.584602 1.527671
C 2.987186 -0.227860 0.308167
C 3.320101 1.572106 1.891925
C -3.741635 -0.348315 0.035946
C 2.613711 -0.252161 -2.064092
C 3.667444 -1.460234 0.227582
C 3.287646 -1.467559 -2.177723
C -4.670696 -0.386718 -1.031056
C -4.141922 -0.838632 1.302280
C 3.795881 -2.060414 -1.017577
C -5.947854 -0.906279 -0.830010
C -5.423575 -1.353741 1.481316
C -6.337044 -1.389315 0.422887
H 1.603774 2.057951 -1.884865
H -0.309067 -0.113224 -1.987454
H -0.425200 1.584745 -2.555093
H 0.486689 0.859073 1.530699
H 0.229496 -0.542394 0.448556
H 1.485597 3.698752 -0.148652
H 3.139571 3.095256 -0.381463
H -2.459560 1.979718 -1.184242
H -2.689887 0.551702 -2.249650
H -1.784328 -0.183997 1.850056
H -1.913635 1.529397 1.326520
H 2.445996 3.544316 2.044063
H 1.261375 2.229372 1.917445
H 4.278858 1.748785 1.377738
H 3.484655 1.504381 2.985302
H 2.208133 0.206904 -2.968284
H 4.067489 -1.913924 1.134401
H 3.411424 -1.948801 -3.146391
H -4.389390 -0.026545 -2.017916
H -3.445241 -0.832448 2.137948
H -6.651306 -0.933808 -1.661972
H -5.716382 -1.732448 2.460460
H -7.334669 -1.789327 0.571862


%chk=000216610-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000216610

0 1
Cl 4.885328 -3.674595 -0.892946
O 2.940010 0.359202 1.664455
N 0.154637 1.289128 -0.513102
N -2.474536 0.106821 -0.163787
C 1.593002 1.581714 -0.858698
C -0.680177 0.916825 -1.682104
C -0.103243 0.310871 0.577408
C 2.116800 2.846635 -0.126414
C -2.178218 0.970353 -1.320939
C -1.582968 0.374142 0.989166
C 2.503918 0.342660 -0.809056
C 2.274917 2.777582 1.403632
C 3.085921 -0.201470 0.375042
C 3.339931 1.775959 1.864645
C -3.801259 -0.342725 0.052527
C 2.702098 -0.386063 -2.012834
C 3.805445 -1.420151 0.348151
C 3.416109 -1.602263 -2.068106
C -4.878356 0.064573 -0.793863
C -4.102841 -1.263213 1.104029
C 3.954551 -2.104141 -0.868303
C -6.183204 -0.438836 -0.602771
C -5.410685 -1.750223 1.290574
C -6.468292 -1.348860 0.439245
H 1.565139 1.880996 -1.924809
H -0.441541 -0.111422 -2.052447
H -0.496628 1.634103 -2.503749
H 0.527486 0.539446 1.450320
H 0.134692 -0.730902 0.253873
H 1.410731 3.661675 -0.373019
H 3.097631 3.112061 -0.575084
H -2.463011 2.030457 -1.121554
H -2.753273 0.617291 -2.194905
H -1.757215 -0.368073 1.782752
H -1.796838 1.383344 1.411052
H 2.575223 3.778989 1.774456
H 1.308499 2.543837 1.886625
H 4.303023 1.955504 1.343809
H 3.502668 1.844060 2.953325
H 2.275189 0.011603 -2.941570
H 4.230557 -1.799870 1.280722
H 3.546762 -2.139740 -3.011055
H -4.711499 0.794168 -1.591987
H -3.309391 -1.627412 1.764631
H -6.984985 -0.102001 -1.270949
H -5.601129 -2.461826 2.102974
H -7.482478 -1.734610 0.585944


