%chk=000287683.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287683

0 1
Cl -2.712654 -3.685240 -0.026851
N -3.834253 1.563475 -0.205840
N 2.605952 -1.185318 0.122638
C -0.858344 1.394459 -0.434682
C 0.339112 0.508927 -0.238935
C -1.576818 1.662644 0.896585
C -2.931378 2.361246 0.690894
C 0.178336 -0.889564 -0.107817
C 1.639995 1.053149 -0.179700
C 1.350710 -1.705295 0.069047
C 2.755574 0.162269 0.003624
C -1.104380 -1.545678 -0.138489
C 1.918730 2.464726 -0.292366
C 1.214382 -3.144987 0.201037
C 4.099250 0.701724 0.068789
C -5.037572 2.374772 -0.564244
C -4.250351 0.279883 0.432596
C -1.174652 -2.898561 -0.003250
C 3.193674 2.940093 -0.225269
C -0.014369 -3.727183 0.166180
C 4.303084 2.042468 -0.041358
H -1.571577 0.932825 -1.158506
H -0.577934 2.356986 -0.910928
H -1.716283 0.714410 1.452978
H -0.938808 2.294941 1.545412
H -3.385371 2.573372 1.683474
H -2.762310 3.346935 0.202147
H -2.011691 -0.936385 -0.265099
H 1.072566 3.140305 -0.435147
H 2.131453 -3.725531 0.327764
H 4.918112 -0.006628 0.207326
H -5.658007 1.798789 -1.270237
H -5.669108 2.670239 0.285808
H -4.715100 3.285395 -1.093552
H -4.664535 0.374856 1.445988
H -3.368657 -0.390660 0.474534
H -4.998853 -0.223998 -0.199128
H 3.404588 4.004915 -0.309870
H -0.146001 -4.805701 0.262780
H 5.305888 2.467025 0.005565


%chk=000287683-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287683

0 1
Cl -3.033932 -3.395339 -0.405289
N -3.805363 1.220116 0.054424
N 2.553035 -1.212949 0.065342
C -0.793792 1.623750 -0.501773
C 0.369462 0.668904 -0.315851
C -1.533904 1.957244 0.829619
C -3.001219 2.363555 0.562500
C 0.127341 -0.740802 -0.247320
C 1.716326 1.125627 -0.166296
C 1.259438 -1.643494 -0.057680
C 2.780271 0.137614 0.017431
C -1.196236 -1.306331 -0.355452
C 2.087592 2.519185 -0.180342
C 1.024385 -3.063285 0.003758
C 4.141722 0.583107 0.159646
C -4.941142 1.638175 -0.795527
C -4.243288 0.303645 1.131730
C -1.353820 -2.680204 -0.280253
C 3.413958 2.914756 -0.034291
C -0.259088 -3.586130 -0.104527
C 4.454810 1.937485 0.134235
H -1.540925 1.173214 -1.179756
H -0.463257 2.562581 -0.979328
H -1.509732 1.078205 1.500295
H -1.011559 2.772607 1.366873
H -3.448466 2.798330 1.490942
H -3.018929 3.161216 -0.205307
H -2.068016 -0.654987 -0.485087
H 1.312244 3.282148 -0.301933
H 1.896203 -3.709614 0.140791
H 4.905437 -0.189671 0.289757
H -5.441549 0.743537 -1.207584
H -5.710007 2.236755 -0.245583
H -4.573499 2.244599 -1.642095
H -4.984951 0.775852 1.823077
H -3.378018 -0.024669 1.732540
H -4.702557 -0.598544 0.690559
H 3.671947 3.979588 -0.046437
H -0.442086 -4.663379 -0.056352
H 5.493564 2.267698 0.244441


