%chk=000229948.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229948

0 1
Cl 6.447376 -0.517895 -0.000264
N -4.715757 -2.999076 -0.000457
C -1.878802 -0.666580 -0.000136
C -2.567753 0.589486 -0.000075
C -0.405725 -0.416041 -0.000135
C -1.566024 1.662011 -0.000047
C -0.260056 1.060945 -0.000104
C -2.567481 -1.861676 -0.000209
C -3.954420 0.628828 -0.000078
C 0.535082 -1.368512 -0.000085
C -1.712540 3.038768 0.000012
C 0.871719 1.857114 -0.000104
C -3.992461 -1.808113 -0.000220
C -4.674397 -0.571546 -0.000139
C -0.551322 3.836535 0.000010
C 0.714937 3.258255 -0.000047
C 1.988821 -1.133480 -0.000130
C 2.683355 -1.036377 -1.217438
C 2.683577 -1.037423 1.217137
C 4.066793 -0.844985 -1.222604
C 4.067009 -0.846028 1.222218
C 4.736417 -0.753625 -0.000216
H -2.050322 -2.814206 -0.000285
H -4.483331 1.581120 -0.000020
H 0.259352 -2.428599 -0.000018
H -2.696062 3.499489 0.000073
H 1.870215 1.422142 -0.000127
H -5.759173 -0.545089 -0.000161
H -0.653091 4.920908 0.000059
H 1.601371 3.889800 -0.000050
H 2.139155 -1.105766 -2.159422
H 2.139545 -1.107617 2.159156
H -5.716122 -2.997810 0.000129
H -4.255398 -3.886798 0.000101
H 4.613660 -0.767961 -2.162135
H 4.614051 -0.769799 2.161711


%chk=000229948-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229948

0 1
Cl 6.639912 -0.626235 -0.000352
N -4.749006 -3.041809 0.000069
C -1.900673 -0.643992 -0.000054
C -2.593673 0.607242 -0.000232
C -0.428411 -0.379786 -0.000028
C -1.595609 1.691536 -0.000296
C -0.283468 1.105838 -0.000173
C -2.600583 -1.860815 0.000052
C -4.002824 0.625176 -0.000301
C 0.537331 -1.349744 0.000158
C -1.756973 3.091481 -0.000419
C 0.859305 1.932326 -0.000133
C -4.028068 -1.844951 -0.000011
C -4.715224 -0.591681 -0.000188
C -0.603208 3.913316 -0.000399
C 0.692217 3.340049 -0.000246
C 2.017178 -1.143514 0.000056
C 2.739386 -1.063342 -1.220360
C 2.739917 -1.066144 1.220336
C 4.144048 -0.905200 -1.230022
C 4.144579 -0.907994 1.229749
C 4.825011 -0.830003 -0.000196
H -2.071918 -2.822364 0.000176
H -4.553775 1.572231 -0.000436
H 0.208172 -2.399970 0.000374
H -2.755157 3.543359 -0.000517
H 1.865562 1.505023 -0.000009
H -5.812149 -0.583967 -0.000240
H -0.712597 5.003946 -0.000492
H 1.574044 3.990072 -0.000214
H 2.198844 -1.116975 -2.171375
H 2.199797 -1.121947 2.171467
H -5.764397 -3.036837 0.000165
H -4.272523 -3.938484 0.000359
H 4.693095 -0.840261 -2.173875
H 4.694036 -0.845180 2.173507


