%chk=000295058.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295058

0 1
Cl 6.394842 1.338064 0.113184
O -0.009197 -1.200900 -0.032203
N -1.017662 0.899616 0.041499
N 1.336276 0.692231 0.052502
C -2.399100 0.505384 0.016159
C -3.384705 1.529958 0.047760
C -4.135426 -1.194029 -0.061299
C -2.777355 -0.841011 -0.037824
C -4.731125 1.151747 0.023536
C -5.112506 -0.191078 -0.030308
C -3.028987 2.981744 0.105469
C -4.517461 -2.636812 -0.119163
C 0.081963 0.010007 0.015758
C 2.613035 0.053854 0.036393
C 3.743307 0.900682 0.077468
C 2.773250 -1.343131 -0.017187
C 5.004054 0.309192 0.063134
C 4.056121 -1.889681 -0.029641
C 5.191563 -1.071513 0.010353
H -2.018635 -1.631474 -0.062258
H -5.503279 1.921480 0.047143
H -6.167681 -0.451715 -0.047948
H -0.846074 1.904959 0.081128
H -2.462765 3.226287 1.014681
H -2.445793 3.293339 -0.771942
H -3.923405 3.622172 0.120928
H -4.109210 -3.119968 -1.019489
H -4.121055 -3.187765 0.746866
H -5.603468 -2.791508 -0.132357
H 1.354228 1.712400 0.093573
H 3.645559 1.982482 0.119126
H 1.896967 -2.001493 -0.049080
H 4.176199 -2.973934 -0.071275
H 6.190925 -1.500988 0.000514


%chk=000295058-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000295058

0 1
Cl 6.382132 1.658946 0.110688
O -0.009104 -1.391840 -0.033225
N -1.021815 0.742148 0.036375
N 1.302926 0.567246 0.044556
C -2.411092 0.414578 0.013152
C -3.332996 1.510227 0.049858
C -4.269787 -1.198089 -0.064987
C -2.881013 -0.920384 -0.043395
C -4.712035 1.211134 0.027824
C -5.184531 -0.119511 -0.028718
C -2.854356 2.952278 0.111469
C -4.752129 -2.637608 -0.126646
C 0.075686 -0.130936 0.013565
C 2.612131 0.017089 0.033764
C 3.694789 0.940934 0.070526
C 2.880624 -1.378570 -0.010602
C 5.010049 0.452134 0.062275
C 4.218888 -1.823298 -0.017463
C 5.308356 -0.922078 0.018692
H -2.153558 -1.734385 -0.069586
H -5.430639 2.039126 0.055732
H -6.262519 -0.315894 -0.044591
H -0.826866 1.743879 0.075218
H -2.257284 3.161277 1.023276
H -2.241654 3.233222 -0.770203
H -3.713658 3.642333 0.131486
H -4.380261 -3.145636 -1.035997
H -4.386815 -3.219808 0.739844
H -5.854140 -2.694882 -0.133100
H 1.269822 1.588389 0.077728
H 3.513221 2.021077 0.105034
H 2.047697 -2.081600 -0.038792
H 4.420297 -2.899353 -0.051830
H 6.343033 -1.273550 0.013273


