%chk=000184366.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184366

0 1
S -1.999208 0.574221 2.070907
N 4.219337 0.095661 -0.394810
C 3.443088 1.221445 0.223529
C 3.475520 -1.106567 0.107853
C 3.275307 0.752450 1.693869
C 3.308978 -0.791598 1.618718
C 2.064625 1.364194 -0.470122
C 2.095465 -1.214040 -0.588502
C 1.297773 0.065359 -0.508510
C -0.051706 0.041042 -0.489826
C -0.835508 -1.216108 -0.483210
C -0.898284 1.252412 -0.447634
C -1.322459 -1.697096 0.752383
C -1.754790 1.538822 0.622003
C -1.119957 -1.905404 -1.666357
C -0.998470 -0.939647 1.992708
C -0.863241 2.139503 -1.542286
C -2.093342 -2.865371 0.782158
C -2.547936 2.697418 0.615404
C -1.886953 -3.074679 -1.624845
C -1.650138 3.289321 -1.553191
C -2.372448 -3.551676 -0.404571
C -2.491592 3.571752 -0.469070
H 4.020793 2.166303 0.144609
H 4.075838 -2.023620 -0.069376
H 2.338498 1.121466 2.137461
H 4.100449 1.134682 2.316630
H 4.161179 -1.194149 2.190783
H 2.398098 -1.244038 2.035638
H 2.201439 1.736335 -1.505171
H 1.475329 2.151466 0.045083
H 1.528081 -2.060754 -0.150010
H 2.231199 -1.483945 -1.655529
H 4.221955 0.146351 -1.416045
H -0.751076 -1.524943 -2.616888
H -1.244679 -1.499177 2.919131
H 0.082215 -0.690214 2.049321
H -0.217800 1.913170 -2.389539
H -2.484225 -3.238192 1.727198
H -3.213734 2.919840 1.451830
H -2.109552 -3.609322 -2.546330
H -1.615151 3.966822 -2.404234
H -2.974284 -4.458297 -0.375191
H -3.105433 4.470701 -0.475669


%chk=000184366-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000184366

0 1
S -2.055554 0.637507 2.257235
N 4.292312 0.088075 -0.293587
C 3.454821 1.211867 0.222691
C 3.482749 -1.114042 0.065569
C 3.148966 0.727592 1.669792
C 3.187363 -0.838217 1.567079
C 2.144853 1.376360 -0.620830
C 2.166652 -1.185964 -0.780648
C 1.331068 0.084399 -0.626090
C -0.030417 0.051528 -0.437556
C -0.805680 -1.239774 -0.408818
C -0.882659 1.289928 -0.356797
C -1.329418 -1.721636 0.826606
C -1.801719 1.582696 0.695623
C -1.082019 -1.955414 -1.599853
C -1.017123 -0.955118 2.081511
C -0.837886 2.197968 -1.455953
C -2.114728 -2.899851 0.846344
C -2.622215 2.740656 0.628043
C -1.859280 -3.134965 -1.572894
C -1.641683 3.351893 -1.519182
C -2.379948 -3.608426 -0.346209
C -2.543899 3.624732 -0.464698
H 4.025549 2.157287 0.205040
H 4.071303 -2.035965 -0.088407
H 2.172533 1.105055 2.021769
H 3.925547 1.091105 2.363480
H 3.997779 -1.249473 2.192125
H 2.240770 -1.310622 1.884145
H 2.448193 1.645085 -1.656379
H 1.543865 2.218592 -0.234845
H 1.578101 -2.079460 -0.505030
H 2.461387 -1.314380 -1.845434
H 4.489780 0.158976 -1.304654
H -0.689267 -1.576392 -2.550155
H -1.286111 -1.510674 2.994832
H 0.040683 -0.654092 2.133810
H -0.157110 1.964525 -2.282466
H -2.518309 -3.261647 1.799731
H -3.324156 2.946216 1.444606
H -2.062984 -3.677641 -2.502747
H -1.575277 4.021904 -2.382958
H -2.987361 -4.519872 -0.320063
H -3.186276 4.511578 -0.493477


