%chk=000248685.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248685

0 1
Cl 3.501446 2.141524 0.405221
O 5.583503 0.052912 -0.167326
N -0.401569 0.132125 0.083157
N 0.828252 0.735987 0.192872
N 4.141216 -1.675847 -0.518863
N 2.918473 -2.220019 -0.601544
C -1.503949 0.803812 0.280781
C -1.647501 2.264300 0.638077
C -2.761437 0.018489 0.147101
C -1.342472 3.174547 -0.547518
C -3.752056 0.442810 -0.752492
C -2.960154 -1.133963 0.921727
C 1.958863 -0.042891 -0.046787
C -4.939252 -0.283623 -0.868321
C -4.153070 -1.852939 0.801609
C -5.142422 -1.429284 -0.090729
C 3.227107 0.504191 0.030935
C 1.860962 -1.464892 -0.381572
C 4.421563 -0.285674 -0.201844
H -2.678943 2.463729 1.004778
H -0.993840 2.512740 1.500789
H -1.480946 4.229841 -0.278607
H -2.007099 2.966837 -1.396709
H -0.315343 3.064363 -0.913911
H -3.592924 1.330408 -1.362802
H -2.183700 -1.470405 1.608705
H 0.930398 1.736290 0.404852
H -5.707834 0.041685 -1.568183
H -4.308442 -2.747733 1.403277
H -6.070048 -1.992216 -0.183390
H 0.869074 -1.937186 -0.459288
H 4.924843 -2.319617 -0.701598


%chk=000248685-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248685

0 1
Cl 3.387274 2.319406 0.335296
O 5.676538 0.197864 0.077089
N -0.409849 0.037837 0.113024
N 0.821831 0.667173 0.161863
N 4.233623 -1.636021 -0.126345
N 3.029033 -2.282077 -0.195451
C -1.509081 0.777225 0.217748
C -1.492022 2.295092 0.368408
C -2.800139 0.042497 0.139666
C -1.377830 3.032256 -0.997008
C -4.034468 0.733523 -0.019214
C -2.830405 -1.381512 0.213801
C 1.988009 -0.077052 0.069723
C -5.254587 0.027231 -0.100408
C -4.047504 -2.082988 0.136188
C -5.269400 -1.382870 -0.021113
C 3.250156 0.524840 0.129367
C 1.937955 -1.519325 -0.099702
C 4.488448 -0.231570 0.034472
H -2.405661 2.624813 0.889947
H -0.658560 2.608521 1.030344
H -1.348316 4.126029 -0.846367
H -2.241786 2.797104 -1.642939
H -0.465528 2.739138 -1.547441
H -4.054147 1.825782 -0.094060
H -1.885440 -1.917601 0.339352
H 0.919592 1.685161 0.277603
H -6.192455 0.579299 -0.226723
H -4.048785 -3.176640 0.202821
H -6.216631 -1.930054 -0.079208
H 0.974457 -2.024599 -0.157086
H 5.058375 -2.238181 -0.201248


