%chk=000268860.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268860

0 1
Cl 5.964578 0.064309 2.040423
O -0.311840 -0.495653 -1.445702
O -1.673206 2.091631 -0.244482
O -3.142747 0.124453 0.355319
O -0.944341 -3.438184 -1.421318
O -2.262819 2.855062 1.811235
O -3.736031 -1.731745 1.501940
O 1.271138 -3.154358 -1.823603
N 2.259910 -0.745043 -0.484030
N 3.448999 -0.787176 0.131001
N 2.047258 2.292653 1.449737
N 4.263201 2.025472 2.452934
C -0.900574 1.020939 0.341163
C -1.754301 -0.262824 0.477132
C 0.157404 0.675898 -0.734290
C -1.375307 -1.163268 -0.721165
C 1.492968 0.371035 -0.148596
C -0.897705 -2.547758 -0.274431
C 2.270676 1.111915 0.766064
C 3.507452 0.342264 0.915506
C -2.318874 2.976035 0.614367
C -4.077643 -0.704356 0.968938
C 4.487187 0.888710 1.806353
C 0.209814 -3.641829 -2.145536
C -3.004211 3.998573 -0.219036
C -5.421629 -0.097023 0.812584
C 3.036340 2.689317 2.248421
C -0.092167 -4.541345 -3.288344
H -0.477727 1.365831 1.314949
H -1.603666 -0.754239 1.466209
H 0.224091 1.466088 -1.524476
H -2.197795 -1.241089 -1.470989
H -1.620454 -3.025426 0.422658
H 0.116360 -2.538393 0.161847
H 1.961683 -1.501585 -1.129979
H -3.034043 3.721728 -1.286139
H -2.484044 4.968614 -0.146276
H -4.038347 4.156515 0.123636
H -5.442556 0.695044 0.045831
H -5.752639 0.360620 1.761747
H -6.171256 -0.858363 0.541412
H 2.921842 3.622992 2.823899
H 0.590732 -5.407403 -3.297989
H -1.125758 -4.925236 -3.266031
H 0.045243 -4.012999 -4.247092


%chk=000268860-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268860

0 1
Cl 5.596202 -0.554477 2.844138
O -0.275503 -0.403135 -1.627717
O -1.710280 2.092359 -0.758875
O -3.028175 0.179754 0.672196
O -1.058572 -3.222763 -1.865011
O -2.428286 3.204446 1.172263
O -3.141202 -1.726428 2.014450
O 1.267582 -3.010694 -1.832676
N 2.134039 -0.936920 -0.227164
N 3.248099 -1.141708 0.571850
N 2.032977 2.159005 1.576039
N 4.028442 1.661739 2.906625
C -0.864976 1.206577 0.068053
C -1.616333 -0.112116 0.380117
C 0.285617 0.719927 -0.833446
C -1.442472 -0.974597 -0.902151
C 1.483143 0.263127 -0.034238
C -1.192574 -2.455620 -0.595822
C 2.222575 0.930374 0.973552
C 3.305839 0.018292 1.311778
C -2.475114 3.058079 -0.064330
C -3.681232 -0.689316 1.573037
C 4.195516 0.481108 2.323747
C 0.216838 -3.415544 -2.385806
C -3.312202 3.842000 -1.047011
C -5.060186 -0.167044 1.887541
C 2.951667 2.456407 2.513406
C 0.159729 -4.164221 -3.694347
H -0.531470 1.744586 0.970653
H -1.160712 -0.608079 1.258128
H 0.566237 1.509253 -1.552514
H -2.324516 -0.857975 -1.558214
H -2.061735 -2.897909 -0.085049
H -0.285738 -2.595481 0.018654
H 1.843900 -1.703152 -0.877020
H -4.071038 3.179859 -1.500139
H -2.683265 4.229451 -1.865936
H -3.811567 4.673265 -0.529297
H -5.626586 0.009699 0.957301
H -4.977279 0.802916 2.408824
H -5.594915 -0.886044 2.523813
H 2.861371 3.413661 3.032665
H 1.133163 -4.635121 -3.894130
H -0.642971 -4.917473 -3.683092
H -0.058841 -3.449666 -4.509045


