%chk=000118877.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000118877

0 1
S -1.313371 1.201881 0.910107
S 2.417818 -0.832960 -1.626070
F 4.601605 2.775197 -2.333342
F 5.002042 0.738168 -1.933015
F 3.354646 1.280473 -3.151794
O -1.471681 -1.396580 1.430560
N -5.257724 0.659584 0.127093
N 0.634401 -0.631479 0.857187
N 2.551297 -3.344503 -0.842443
C -6.049175 1.463758 -0.854370
C -5.803214 -0.689362 0.487274
C -3.786655 0.633743 -0.130254
C -5.754542 2.953307 -0.609798
C -5.815168 1.107991 -2.332622
C -7.194784 -0.529282 1.116613
C -5.842459 -1.701154 -0.669641
C -3.102820 1.015959 1.185391
C 1.478144 0.512294 0.599748
C -0.746733 -0.490332 1.111538
C 2.310451 0.531510 -0.530252
C 1.178767 -1.939405 0.595774
C 3.108047 1.650493 -0.801521
C 2.022859 -2.147891 -0.518980
C 1.501038 1.590801 1.503656
C 3.082938 2.749578 0.063065
C 0.874333 -3.042707 1.410289
C 2.289236 2.706178 1.215994
C 3.993867 1.618917 -2.019617
C 1.415059 -4.287865 1.080437
C 2.241461 -4.405220 -0.050453
H -7.134344 1.280531 -0.621620
H -5.111674 -1.094734 1.278754
H -3.512858 1.354655 -0.932716
H -3.430820 -0.362505 -0.477123
H -5.873726 3.202729 0.451791
H -6.437839 3.586609 -1.183375
H -4.733069 3.226017 -0.893187
H -6.440450 1.722886 -2.987593
H -4.776341 1.265064 -2.639220
H -6.061012 0.056038 -2.530694
H -7.183237 0.238564 1.900661
H -7.526074 -1.467488 1.572726
H -7.950880 -0.233507 0.380872
H -6.294322 -2.646233 -0.352308
H -6.425166 -1.326433 -1.521385
H -4.835985 -1.929268 -1.036895
H -3.476336 1.988341 1.567120
H -3.302507 0.264746 1.976941
H 0.920856 1.559119 2.429853
H 3.685193 3.637792 -0.138605
H 0.206413 -2.928340 2.269008
H 2.292456 3.554118 1.903560
H 1.193436 -5.161360 1.692456
H 2.678698 -5.366532 -0.346476


%chk=000118877-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000118877

0 1
S -1.277449 1.621490 0.808624
S 2.208330 -0.881212 -1.750930
F 5.022214 2.723957 -2.081575
F 5.262089 0.482578 -1.902397
F 3.600428 1.347393 -3.182005
O -1.643814 -1.063710 1.274650
N -5.226581 0.590399 -0.111086
N 0.566397 -0.455207 0.786790
N 2.146657 -3.434502 -0.800420
C -6.252003 1.310950 -0.910620
C -5.495401 -0.807016 0.332193
C -3.811921 0.913184 -0.343196
C -6.362540 2.788516 -0.458341
C -6.055696 1.231888 -2.453912
C -6.663942 -0.874624 1.343550
C -5.709012 -1.817167 -0.831711
C -3.158312 1.370932 0.980780
C 1.568458 0.566233 0.581235
C -0.801663 -0.171594 1.005199
C 2.402040 0.508943 -0.565548
C 0.981387 -1.825530 0.621386
C 3.374564 1.529006 -0.758979
C 1.747190 -2.178191 -0.519468
C 1.758422 1.572738 1.556556
C 3.512435 2.569917 0.187035
C 0.639519 -2.851221 1.530445
C 2.713571 2.585418 1.347868
C 4.293196 1.517709 -1.954151
C 1.047916 -4.173233 1.244731
C 1.787728 -4.424565 0.068196
H -7.216896 0.821703 -0.675165
H -4.578123 -1.121019 0.869910
H -3.718086 1.720798 -1.090928
H -3.242898 0.044241 -0.738499
H -6.593495 2.843514 0.619682
H -7.155496 3.316255 -1.020982
H -5.412714 3.328963 -0.634696
H -6.911397 1.703414 -2.972828
H -5.142036 1.767879 -2.772755
H -5.977090 0.186551 -2.797267
H -6.486127 -0.178292 2.181601
H -6.763900 -1.899350 1.746995
H -7.630069 -0.609724 0.874015
H -5.763973 -2.850310 -0.440357
H -6.651441 -1.611898 -1.372828
H -4.873796 -1.772075 -1.554601
H -3.547899 2.345133 1.318930
H -3.298103 0.616398 1.770936
H 1.140116 1.565987 2.458448
H 4.254882 3.353362 0.014603
H 0.044994 -2.619266 2.416393
H 2.841016 3.378414 2.090068
H 0.790993 -4.995821 1.918223
H 2.107422 -5.436437 -0.200696


