%chk=000261328.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261328

0 1
Cl -8.024782 0.074842 -0.468149
S 0.818244 3.878969 0.318368
N 0.091916 1.371432 0.439258
N -2.278707 -0.316912 1.011113
C 0.098778 -0.088775 0.155142
C -0.992252 1.836673 1.356044
C -1.326391 -0.606142 -0.112483
C -1.709725 0.639813 1.999580
C 0.975916 2.259718 -0.068148
C -3.642661 -0.135737 0.610892
C 2.083952 1.835534 -0.988599
C 3.047948 0.855965 -0.372340
C -4.176434 -0.981788 -0.390951
C -4.500873 0.772311 1.270123
C 3.413448 -0.347544 -1.072752
C 4.323942 -1.247101 -0.457466
C 3.598903 1.129566 0.860538
C -5.528336 -0.916517 -0.721246
C -5.853741 0.834990 0.941655
C 2.901942 -0.674657 -2.369792
C 4.866738 -0.937514 0.829634
C 4.514455 0.225011 1.466513
C -6.352838 -0.007235 -0.053956
C 4.690131 -2.453237 -1.138380
C 3.270177 -1.834234 -3.003092
C 4.175691 -2.739822 -2.376952
H 0.738463 -0.321447 -0.726723
H 0.559827 -0.623456 1.020449
H -1.707174 2.472162 0.778098
H -0.559701 2.497046 2.149758
H -1.290453 -1.716004 -0.224663
H -1.695468 -0.185108 -1.076263
H -2.502672 1.009403 2.691099
H -1.007143 0.054689 2.640350
H 1.656596 1.456940 -1.947138
H 2.668388 2.742457 -1.303380
H -3.546941 -1.710350 -0.896625
H -4.114557 1.431360 2.048011
H 3.345784 2.050788 1.391192
H -5.939800 -1.570964 -1.490952
H -6.513591 1.536983 1.453476
H 2.220441 0.028079 -2.854068
H 5.565605 -1.637064 1.285756
H 4.928562 0.478295 2.442468
H 5.388301 -3.133789 -0.651899
H 2.884382 -2.079257 -3.991719
H 4.451108 -3.653675 -2.901678


%chk=000261328-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000261328

0 1
Cl -8.168375 -1.480799 1.054641
S 1.594226 4.088988 0.105413
N 0.153018 1.786560 0.044656
N -2.501053 0.626400 0.478586
C -0.167389 0.382738 -0.316186
C -0.888411 2.492312 0.836239
C -1.660050 0.232248 -0.664878
C -1.878932 1.507782 1.482480
C 1.306946 2.442951 -0.310652
C -3.808087 0.137943 0.619148
C 2.354297 1.662070 -1.101806
C 3.028924 0.517120 -0.336235
C -4.469144 -0.510941 -0.471280
C -4.525575 0.267903 1.849652
C 3.656294 -0.574518 -1.050319
C 4.300346 -1.634594 -0.293357
C 3.086698 0.541675 1.063209
C -5.782878 -1.003650 -0.338270
C -5.842899 -0.216148 1.979087
C 3.683806 -0.659528 -2.484920
C 4.322398 -1.570111 1.138605
C 3.733015 -0.495416 1.803164
C -6.461109 -0.848858 0.884595
C 4.914480 -2.726650 -0.991957
C 4.293639 -1.734415 -3.137414
C 4.911468 -2.782454 -2.386396
H 0.434790 0.070629 -1.182023
H 0.093375 -0.291503 0.523119
H -1.420774 3.207915 0.179608
H -0.383532 3.097762 1.611400
H -1.841647 -0.832404 -0.911211
H -1.892851 0.828639 -1.574494
H -2.661020 2.117400 1.969346
H -1.370701 0.926389 2.283163
H 1.894238 1.281947 -2.036078
H 3.117584 2.396661 -1.412312
H -3.973875 -0.611934 -1.441225
H -4.053774 0.721042 2.726163
H 2.637499 1.383656 1.602307
H -6.273710 -1.491763 -1.185594
H -6.374057 -0.111335 2.929940
H 3.236183 0.138576 -3.086168
H 4.815495 -2.373075 1.699182
H 3.762229 -0.437560 2.896710
H 5.393981 -3.520207 -0.406244
H 4.305068 -1.774346 -4.232242
H 5.385246 -3.620401 -2.909051


