%chk=000193844.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193844

0 1
Br -8.612224 -0.463984 -0.341421
Cl 4.844849 -4.590873 0.519253
N 4.196483 3.308128 -0.202918
C 1.786584 0.546543 0.267221
C 0.315179 0.401534 0.176660
C 3.853774 1.974533 0.398024
C 2.372262 1.754637 0.288191
C 2.545326 -0.724893 0.333535
C -2.475657 0.129931 0.013832
C -0.368488 -0.432765 1.076869
C -0.406839 1.094995 -0.808263
C -1.754455 -0.567332 0.996481
C -1.793852 0.961416 -0.888031
C -3.945362 -0.012373 -0.070902
C 2.609632 -1.558711 -0.795175
C 3.192166 -1.100975 1.522151
C 4.164712 3.237415 -1.694383
C 5.541136 3.758318 0.265314
C -4.522015 -1.281288 -0.244333
C -4.769901 1.120888 0.021780
C 3.322685 -2.758388 -0.743492
C 3.905553 -2.300248 1.586020
C 3.960613 -3.109018 0.448778
C -5.909986 -1.419665 -0.326772
C -6.158891 0.990512 -0.056527
C -6.711548 -0.280089 -0.231001
H 4.124055 1.991098 1.481267
H 4.425391 1.131211 -0.050898
H 1.778056 2.674339 0.244020
H 0.187753 -0.975995 1.840791
H 0.117055 1.737175 -1.515024
H -2.280413 -1.210122 1.701898
H -2.348356 1.498541 -1.656922
H 2.097595 -1.267870 -1.712728
H 3.133551 -0.456115 2.398534
H 4.913402 2.568763 -2.143598
H 4.316337 4.250622 -2.100091
H 3.166726 2.902958 -2.020175
H 5.515010 3.889354 1.359108
H 6.372600 3.084391 0.013344
H 5.757105 4.748168 -0.169208
H -3.883921 -2.161826 -0.321595
H -4.325001 2.106115 0.162591
H 3.378601 -3.410118 -1.615124
H 4.408386 -2.600183 2.504975
H -6.353917 -2.406482 -0.464482
H -6.796050 1.872628 0.019123


%chk=000193844-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000193844

0 1
Br -8.767504 -0.335038 -0.564630
Cl 5.152045 -4.690391 0.434836
N 4.165444 3.284066 -0.226999
C 1.832012 0.489925 0.408615
C 0.347823 0.367825 0.250377
C 3.878932 2.084585 0.602725
C 2.409048 1.729532 0.532901
C 2.635306 -0.774068 0.429589
C -2.519092 0.148517 -0.002279
C -0.359950 -0.742932 0.789178
C -0.413351 1.359170 -0.431447
C -1.758547 -0.847505 0.669423
C -1.811044 1.253832 -0.551577
C -3.997661 0.034826 -0.134723
C 2.414793 -1.788431 -0.543792
C 3.635225 -1.000232 1.414198
C 4.028614 3.016129 -1.673951
C 5.466246 3.899861 0.101675
C -4.631130 -1.234980 -0.232859
C -4.824467 1.191920 -0.167493
C 3.177910 -2.975124 -0.554516
C 4.402770 -2.186084 1.426410
C 4.165771 -3.155132 0.433989
C -6.031338 -1.353330 -0.358329
C -6.226393 1.093979 -0.293872
C -6.816981 -0.182952 -0.388082
H 4.145322 2.345503 1.648618
H 4.515762 1.210871 0.317233
H 1.756584 2.612734 0.571049
H 0.191489 -1.520253 1.329013
H 0.101916 2.204539 -0.901006
H -2.270113 -1.696770 1.136353
H -2.355670 2.017274 -1.118708
H 1.643743 -1.643262 -1.308004
H 3.792713 -0.256710 2.202702
H 4.790143 2.291359 -2.059746
H 4.134719 3.960344 -2.237323
H 3.028121 2.599582 -1.884003
H 5.496086 4.161667 1.174618
H 6.342900 3.239117 -0.119877
H 5.590092 4.831383 -0.479282
H -4.024529 -2.146892 -0.243088
H -4.375020 2.185228 -0.061942
H 3.007888 -3.742732 -1.314902
H 5.162548 -2.352857 2.195306
H -6.498119 -2.338875 -0.442034
H -6.845358 1.995683 -0.307644


