%chk=000233852.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233852

0 1
Cl 7.771802 -0.020736 -0.189535
O -5.361220 1.205919 -0.192794
O -5.366413 -0.813071 -1.212948
N 1.614954 0.561854 2.802480
C -0.535868 0.126966 0.097566
C -3.288670 0.112589 -0.379450
C 0.928794 0.139926 0.339664
C -1.329756 1.195325 0.544344
C -1.122316 -0.952645 -0.582802
C -2.704543 1.188625 0.304729
C -2.496970 -0.959927 -0.820259
C 3.280982 -0.036568 -0.513139
C 1.818465 -0.036975 -0.656534
C 4.051389 0.719770 -1.416213
C 3.917435 -0.792334 0.485980
C -4.746582 0.064820 -0.655089
C 5.443035 0.732244 -1.316155
C 5.310479 -0.792249 0.589627
C 6.052415 -0.027294 -0.312976
C -6.813813 1.310542 -0.352342
C 1.316469 0.373152 1.701573
C -7.506476 0.480596 0.707133
H -0.874814 2.030735 1.078118
H -0.509373 -1.789759 -0.915832
H -3.332438 2.016949 0.647449
H -2.967108 -1.796543 -1.346979
H 1.461344 -0.182466 -1.685537
H 3.561830 1.307613 -2.193151
H 3.326243 -1.386787 1.184585
H 6.045353 1.322777 -2.007140
H 5.808757 -1.375749 1.365057
H -6.955272 2.398709 -0.219569
H -7.077753 0.998869 -1.378804
H -8.587983 0.660617 0.715021
H -7.352996 -0.595466 0.532683
H -7.122283 0.703072 1.711039


%chk=000233852-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000233852

0 1
Cl 8.002834 -0.452034 -0.499114
O -5.516788 1.146958 0.190874
O -5.256494 -0.018326 -1.817592
N 1.529501 0.781077 2.998950
C -0.518403 0.316929 0.161420
C -3.311476 0.441576 -0.420079
C 0.940274 0.279062 0.477074
C -1.427901 0.946043 1.059444
C -1.045398 -0.269290 -1.026561
C -2.803633 1.011950 0.773956
C -2.417649 -0.203744 -1.314552
C 3.367006 -0.071475 -0.396049
C 1.908801 0.029206 -0.481978
C 4.066464 -0.305710 -1.621316
C 4.141900 0.039598 0.800041
C -4.759547 0.479122 -0.774863
C 5.467786 -0.422547 -1.667180
C 5.544142 -0.075919 0.768332
C 6.191497 -0.304693 -0.463598
C -6.989844 1.222640 -0.055851
C 1.286079 0.549731 1.849444
C -7.692496 -0.031489 0.471519
H -1.050773 1.393682 1.985233
H -0.389364 -0.808273 -1.717721
H -3.492186 1.502737 1.466633
H -2.825791 -0.657575 -2.223449
H 1.526235 -0.105949 -1.502404
H 3.497640 -0.396441 -2.554520
H 3.659929 0.216894 1.763375
H 5.986568 -0.600811 -2.613052
H 6.126839 0.010717 1.689699
H -7.296211 2.130253 0.488394
H -7.157088 1.350846 -1.139671
H -8.786819 0.080005 0.357270
H -7.377063 -0.924216 -0.093814
H -7.471472 -0.187430 1.541504


