%chk=000239138.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239138

0 1
Cl -1.786378 3.011044 1.837491
N -4.287816 -2.517969 -0.395548
N 5.258713 -1.562606 -0.197210
C 0.172512 0.947820 0.745370
C -1.022660 0.069405 0.425184
C 1.488947 0.239456 0.486225
C 0.089736 2.274585 0.014529
C -1.498996 -0.815044 1.408042
C -1.655128 0.103656 -0.820693
C -2.592241 -1.647675 1.169131
C -3.237773 -1.601750 -0.101192
C 2.639131 0.679781 1.165158
C 1.599972 -0.835172 -0.405085
C -2.751408 -0.719798 -1.083994
C -0.785059 3.281280 0.454105
C 0.869040 2.544923 -1.121517
C 3.974612 -1.023966 0.063113
C 3.868208 0.061095 0.967389
C 2.824109 -1.468456 -0.619953
C -3.060068 -2.577351 2.244213
C -0.889306 4.516112 -0.190239
C 0.778325 3.774867 -1.778210
C -5.277958 -2.125432 -1.444430
C -0.097900 4.761811 -1.315097
C 5.359999 -2.954082 -0.727057
C -6.545778 -2.966744 -1.321016
C 6.773417 -3.496598 -0.535610
H 0.141551 1.169949 1.852736
H -1.002251 -0.851037 2.377823
H -1.297809 0.778499 -1.598781
H 2.569969 1.520343 1.856506
H 0.717625 -1.192243 -0.941236
H -3.214672 -0.677923 -2.066063
H 1.559041 1.784030 -1.494204
H 4.745038 0.419775 1.498420
H 2.879407 -2.292160 -1.324785
H -2.979540 -3.626664 1.923656
H -4.103606 -2.382558 2.525095
H -2.464282 -2.482784 3.162234
H -4.743211 -2.904954 0.433907
H -1.578912 5.274123 0.179646
H 1.394998 3.964356 -2.655773
H -5.531871 -1.042284 -1.393159
H -4.798431 -2.302198 -2.435664
H -0.165767 5.719271 -1.828216
H 5.962866 -1.348900 0.509993
H 4.620484 -3.632940 -0.244075
H 5.108085 -2.916759 -1.813186
H -7.233255 -2.756112 -2.149410
H -6.321682 -4.041606 -1.352505
H -7.088338 -2.767666 -0.389903
H 7.524937 -2.840780 -0.995768
H 7.035804 -3.611070 0.522478
H 6.877068 -4.483197 -1.004266


%chk=000239138-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239138

0 1
Cl -1.576031 3.335951 2.052192
N -4.501339 -2.306943 -0.269389
N 5.187887 -1.800833 0.045830
C 0.149437 1.004676 0.785464
C -1.105527 0.171568 0.476065
C 1.459722 0.225634 0.574511
C 0.141233 2.348615 0.039822
C -1.611966 -0.713691 1.462831
C -1.766619 0.206893 -0.772274
C -2.728196 -1.543154 1.243550
C -3.388386 -1.494608 -0.032613
C 2.629460 0.622612 1.277212
C 1.572287 -0.870604 -0.312295
C -2.889304 -0.608747 -1.028718
C -0.606994 3.460807 0.497015
C 0.865692 2.534338 -1.167574
C 3.964632 -1.146932 0.206149
C 3.855083 -0.041750 1.105209
C 2.794940 -1.550556 -0.501825
C -3.239826 -2.471548 2.330455
C -0.652746 4.692895 -0.182593
C 0.836501 3.755143 -1.875688
C -5.262943 -2.307063 -1.520134
C 0.075589 4.839956 -1.384751
C 5.397774 -2.940610 -0.849358
C -6.439044 -3.295054 -1.437532
C 6.857223 -3.421823 -0.782619
H 0.098804 1.252352 1.865623
H -1.113494 -0.757626 2.440630
H -1.416542 0.889430 -1.555108
H 2.575917 1.471762 1.971009
H 0.682837 -1.211696 -0.854144
H -3.380925 -0.548705 -2.004757
H 1.471499 1.699123 -1.535241
H 4.739420 0.285926 1.667662
H 2.834886 -2.397671 -1.193924
H -3.217447 -3.534523 2.012472
H -4.284784 -2.235171 2.620857
H -2.622752 -2.389524 3.240531
H -4.841569 -2.895675 0.488476
H -1.244989 5.519252 0.221327
H 1.409078 3.860061 -2.803702
H -5.648737 -1.287044 -1.738015
H -4.602958 -2.584899 -2.370176
H 0.048207 5.794257 -1.921739
H 5.986339 -1.466368 0.583814
H 4.718214 -3.776129 -0.573424
H 5.146968 -2.659132 -1.895411
H -7.009028 -3.296599 -2.382567
H -6.080325 -4.325163 -1.255282
H -7.133828 -3.017585 -0.622993
H 7.554540 -2.618361 -1.084844
H 7.121629 -3.748046 0.240418
H 7.012000 -4.277716 -1.461833


