%chk=000107405.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000107405

1 1
Cl -1.192126 -1.522566 -2.587570
N 5.218894 1.534393 0.258901
N -4.763680 2.611550 0.186384
C -0.048253 -0.477856 0.007845
C 1.272117 0.033244 0.090897
C -1.223392 0.305591 0.050439
C -0.198090 -1.951381 -0.116020
C 3.950657 1.039264 0.224937
C -3.628535 1.864084 0.122395
C 2.377107 -0.697412 -0.457554
C 1.577399 1.264285 0.752665
C -2.484424 -0.270737 0.425540
C -1.237668 1.684568 -0.339613
C 3.659852 -0.219192 -0.410816
C 2.855487 1.753317 0.828580
C -3.634808 0.468194 0.480025
C -2.380345 2.438873 -0.310353
C -0.734122 -2.533836 -1.274889
C 0.200588 -2.792513 0.937350
C -0.884370 -3.916601 -1.398136
C 0.044792 -4.175542 0.828583
C 6.358715 0.802625 -0.338899
C 5.535841 2.826592 0.907986
C -4.776421 4.046107 -0.179399
C -6.060581 2.028498 0.599231
C -0.495877 -4.737023 -0.335078
H 2.177530 -1.655732 -0.951664
H 0.767025 1.807327 1.251591
H -2.512782 -1.332308 0.698266
H -0.310938 2.131910 -0.716842
H 4.463720 -0.798540 -0.862217
H 3.043434 2.682116 1.363816
H -4.563346 -0.007902 0.791523
H -2.346954 3.475950 -0.639377
H 0.628833 -2.358907 1.843503
H -1.299089 -4.348459 -2.312262
H 0.348449 -4.823543 1.653430
H 6.206305 0.645033 -1.423623
H 6.500946 -0.181319 0.146831
H 7.302566 1.364584 -0.220802
H 4.964431 3.654730 0.448033
H 6.607652 3.074648 0.804561
H 5.310198 2.795773 1.990730
H -4.521745 4.188543 -1.246910
H -4.060863 4.621613 0.437558
H -5.774799 4.491870 -0.019150
H -6.007023 1.626741 1.628902
H -6.369201 1.214790 -0.084512
H -6.863985 2.786912 0.586456
H -0.612820 -5.820755 -0.415474


%chk=000107405-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000107405

1 1
Cl -1.695019 -1.665368 -2.567557
N 5.246509 1.576862 0.317727
N -4.780669 2.679511 0.165456
C -0.058598 -0.532391 -0.037113
C 1.277915 0.005133 0.071035
C -1.240172 0.292621 0.023137
C -0.210375 -2.008595 -0.180161
C 3.969438 1.065573 0.246434
C -3.638731 1.910620 0.119783
C 2.404534 -0.687104 -0.501148
C 1.564466 1.232901 0.769431
C -2.501228 -0.249261 0.457138
C -1.237421 1.673632 -0.386210
C 3.696274 -0.175345 -0.436416
C 2.855583 1.742084 0.866128
C -3.653115 0.525275 0.522992
C -2.388247 2.454081 -0.351699
C -0.959444 -2.640456 -1.213899
C 0.418604 -2.863299 0.775632
C -1.098321 -4.039262 -1.289859
C 0.274517 -4.263200 0.725008
C 6.385270 0.841029 -0.272825
C 5.503429 2.869385 0.987982
C -4.741971 4.108443 -0.211951
C -6.071475 2.086280 0.576961
C -0.489021 -4.853688 -0.308658
H 2.231477 -1.620409 -1.046442
H 0.754464 1.744129 1.299510
H -2.545746 -1.294204 0.781425
H -0.323594 2.099179 -0.812764
H 4.504983 -0.722653 -0.926327
H 3.022031 2.650388 1.450289
H -4.574943 0.071371 0.893949
H -2.342581 3.479504 -0.726215
H 0.999638 -2.400277 1.580275
H -1.665193 -4.484558 -2.112277
H 0.752270 -4.889075 1.484815
H 6.279820 0.749818 -1.370311
H 6.475521 -0.172015 0.160300
H 7.317586 1.384315 -0.063241
H 4.892622 3.677036 0.544862
H 6.562239 3.138379 0.865869
H 5.286111 2.813346 2.071604
H -4.503013 4.237317 -1.284800
H -3.993363 4.658476 0.386821
H -5.725982 4.561031 -0.024108
H -6.040450 1.743597 1.628415
H -6.341334 1.229742 -0.067557
H -6.864247 2.842508 0.487291
H -0.604748 -5.940807 -0.362934


