%chk=000256645.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256645

0 1
S 0.584632 -0.902799 -0.075235
N -4.372426 -0.584149 0.415977
N -2.554457 -1.863808 -0.185204
N -3.146470 1.513558 1.054259
N -0.725575 1.273234 0.789992
C 5.758827 -0.367704 -0.252162
C 6.995412 0.513021 -0.027663
C 4.467565 0.380169 0.104939
C 8.287270 -0.234027 -0.384699
C 3.230599 -0.504249 -0.121119
C 9.525508 0.645488 -0.160886
C 1.959647 0.252850 0.237555
C -5.779072 -0.180106 0.600099
C -6.430213 0.175441 -0.745165
C -3.246799 0.219931 0.600442
C -7.901276 0.565204 -0.551766
C -2.110022 -0.601061 0.226741
C 10.814373 -0.093021 -0.515047
C -0.837721 0.003901 0.348638
C -3.890884 -1.836063 -0.076350
C -8.562657 0.918673 -1.881048
C -1.875915 1.970279 1.123004
H 5.840230 -1.291121 0.353551
H 5.722165 -0.702079 -1.307172
H 7.033405 0.847036 1.027248
H 6.915207 1.436352 -0.633353
H 4.386859 1.303484 -0.501193
H 4.504819 0.713756 1.160295
H 8.251376 -0.568888 -1.439218
H 8.369565 -1.157504 0.220159
H 3.321695 -1.428804 0.486471
H 3.203615 -0.837872 -1.179512
H 9.564305 0.979239 0.894566
H 9.445694 1.569100 -0.767054
H 1.949734 0.579282 1.295641
H 1.831815 1.170216 -0.369288
H -6.327357 -1.008598 1.103111
H -5.808214 0.699959 1.290119
H -5.876552 1.010793 -1.222058
H -6.350504 -0.673505 -1.451578
H -8.455492 -0.263632 -0.068558
H -7.976005 1.427463 0.141362
H 10.943740 -0.994467 0.094676
H 11.692260 0.541990 -0.351905
H 10.825528 -0.404508 -1.565733
H -4.562149 -2.650993 -0.312696
H -8.062760 1.763119 -2.370824
H -8.543684 0.076519 -2.582518
H -9.612413 1.201005 -1.737759
H -1.724829 3.002594 1.478819


%chk=000256645-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000256645

0 1
S 0.525499 -1.361781 -0.019511
N -4.469228 -0.777066 0.486741
N -2.712753 -2.210279 0.077457
N -3.207122 1.336533 0.772467
N -0.788559 1.004106 0.521859
C 5.811512 -0.422927 -0.191858
C 6.992820 0.570589 -0.115514
C 4.433909 0.251917 -0.002248
C 8.370684 -0.104013 -0.301742
C 3.260024 -0.753834 -0.086694
C 9.553355 0.888888 -0.229209
C 1.904351 -0.057968 0.111633
C -5.848412 -0.274890 0.635678
C -6.420290 0.298384 -0.680548
C -3.310227 0.000053 0.530692
C -7.860630 0.828040 -0.498545
C -2.228752 -0.905201 0.278635
C 10.925982 0.206662 -0.415041
C -0.927881 -0.333615 0.283622
C -4.047283 -2.085666 0.207208
C -8.440092 1.413737 -1.804114
C -1.910491 1.759860 0.751685
H 5.943647 -1.209508 0.580079
H 5.833242 -0.942664 -1.172469
H 6.970251 1.092792 0.864039
H 6.862214 1.356147 -0.889134
H 4.301781 1.039908 -0.772300
H 4.409359 0.766779 0.980489
H 8.394226 -0.628232 -1.280246
H 8.504013 -0.888023 0.473020
H 3.395247 -1.540655 0.681964
H 3.283192 -1.261561 -1.071635
H 9.528956 1.413242 0.748076
H 9.419537 1.671243 -1.004224
H 1.813343 0.414896 1.102340
H 1.706148 0.705849 -0.657091
H -6.476899 -1.106855 1.003959
H -5.832534 0.512335 1.410809
H -5.762569 1.117645 -1.028101
H -6.405219 -0.485917 -1.463260
H -8.515355 0.008332 -0.137646
H -7.867296 1.606533 0.290977
H 11.096828 -0.558671 0.365590
H 11.753709 0.937525 -0.358533
H 10.987754 -0.298495 -1.397577
H -4.755271 -2.907568 0.116418
H -7.822412 2.255791 -2.167819
H -8.470764 0.649742 -2.603401
H -9.468825 1.788616 -1.654804
H -1.740321 2.823941 0.938725


