%chk=000210815.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210815

0 1
S 1.108254 1.273841 1.736893
N -1.365177 0.030392 -0.239981
C -0.184846 0.333214 -1.128996
C -2.642437 0.255979 -1.002663
C -1.325740 -1.367051 0.306490
C -0.049340 1.860760 -1.358983
C -3.850232 0.063798 -0.070572
C -2.517685 -1.593182 1.252233
C -3.852172 -1.341976 0.541371
C 1.114890 -0.259363 -0.605701
C -0.280217 2.742263 -0.127514
C 1.754615 0.114218 0.580584
C 0.925430 2.815464 0.791947
C 1.719820 -1.255882 -1.398403
C 2.956698 -0.487364 0.977263
C 2.914465 -1.861214 -1.008899
C 3.535763 -1.480075 0.185607
H -0.357195 -0.115837 -2.153305
H -2.737889 -0.413442 -1.884846
H -2.638670 1.299890 -1.383394
H -0.384859 -1.486091 0.888889
H -1.318252 -2.138964 -0.491629
H -0.774034 2.158770 -2.143202
H 0.952222 2.062107 -1.788715
H -4.785037 0.247232 -0.629257
H -3.811167 0.820272 0.739241
H -2.423706 -0.908648 2.120464
H -2.478887 -2.620157 1.656912
H -4.690776 -1.448178 1.253577
H -4.016673 -2.102140 -0.244823
H -0.548258 3.765617 -0.461810
H -1.166412 2.368618 0.437479
H 1.856778 3.037709 0.240758
H 0.802684 3.612968 1.552348
H 1.246397 -1.564421 -2.329839
H 3.445329 -0.180529 1.904530
H 3.363462 -2.630938 -1.634347
H 4.467053 -1.951059 0.493191


%chk=000210815-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210815

0 1
S 1.040791 1.289789 1.849077
N -1.352993 -0.024348 -0.255588
C -0.178591 0.296893 -1.126614
C -2.640415 0.317920 -0.916136
C -1.370651 -1.433629 0.219038
C -0.096153 1.827893 -1.437977
C -3.833644 0.133423 0.044968
C -2.518260 -1.668385 1.221383
C -3.883259 -1.308214 0.595583
C 1.146036 -0.268519 -0.588800
C -0.308999 2.780961 -0.241552
C 1.756493 0.087740 0.650416
C 0.851183 2.833480 0.763099
C 1.819343 -1.221424 -1.399324
C 2.966601 -0.529340 1.055363
C 3.028336 -1.832862 -1.002220
C 3.600838 -1.494341 0.243088
H -0.320825 -0.200139 -2.124899
H -2.799386 -0.317950 -1.830322
H -2.609565 1.367882 -1.254714
H -0.406297 -1.656226 0.703845
H -1.483494 -2.145689 -0.643415
H -0.849634 2.068960 -2.212458
H 0.889638 2.023063 -1.904599
H -4.772005 0.386262 -0.486128
H -3.720987 0.844429 0.886474
H -2.339065 -1.037152 2.112960
H -2.503705 -2.725980 1.548910
H -4.696230 -1.414321 1.338803
H -4.106886 -2.012271 -0.233082
H -0.455647 3.808716 -0.636504
H -1.231976 2.498158 0.296588
H 1.822305 3.001990 0.265303
H 0.692933 3.638319 1.503234
H 1.366142 -1.500380 -2.358443
H 3.414292 -0.231015 2.009183
H 3.511992 -2.567459 -1.655403
H 4.535943 -1.959633 0.573763


