%chk=000286265.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286265

0 1
S -5.407795 -0.546172 -0.776851
S 5.528455 -0.775415 0.000362
O -1.959179 2.409826 -0.979428
O 2.043999 1.213704 2.139429
O -3.625820 -2.367530 -0.098168
O 3.766147 -1.670116 -1.745278
N -1.103999 1.773036 1.033660
N 1.189581 2.106122 0.225517
C 0.037173 2.713186 0.932491
C -3.122333 0.634493 0.194320
C 3.224879 0.723976 0.078329
C -2.032003 1.667530 -0.014283
C 2.122572 1.326749 0.927476
C -3.907203 0.431979 -1.090409
C 4.017400 -0.288503 0.887249
C -4.794149 -2.167139 -0.267275
C 4.932583 -1.624752 -1.478623
C -5.919300 -3.118014 -0.096957
C 6.068568 -2.193369 -2.243674
H -0.283918 3.624640 0.363901
H 0.349590 3.000181 1.970354
H -2.693675 -0.339724 0.531471
H -3.786505 0.972033 1.021621
H 2.807037 0.233639 -0.833552
H 3.881450 1.541756 -0.295356
H -1.047884 1.070187 1.767579
H 1.139175 2.088676 -0.790822
H -3.285567 -0.058162 -1.867085
H -4.241377 1.402695 -1.521588
H 4.341635 0.134415 1.864944
H 3.404946 -1.183090 1.120684
H -6.447881 -3.307412 -1.046624
H -6.677513 -2.753238 0.615385
H -5.564674 -4.093924 0.275616
H 6.602771 -2.971979 -1.673109
H 6.819807 -1.433021 -2.513680
H 5.724507 -2.659562 -3.182426


%chk=000286265-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000286265

0 1
S -4.788730 -0.988530 -1.290299
S 4.976519 -1.382369 0.047446
O -1.620844 2.510292 -1.190563
O 1.807297 1.200269 2.399395
O -3.273844 -2.281695 0.598295
O 3.343060 -1.193696 -2.150005
N -1.153479 2.018201 1.026027
N 1.217349 2.272525 0.427938
C 0.030151 2.889004 1.032344
C -3.132404 0.958392 -0.023579
C 3.247513 0.853745 0.435185
C -1.913915 1.882717 -0.123928
C 2.038189 1.440661 1.172478
C -3.189600 0.015530 -1.239753
C 3.379979 -0.649337 0.741637
C -4.364099 -2.275503 -0.016736
C 4.469850 -1.546507 -1.734186
C -5.466014 -3.299321 0.178032
C 5.554838 -2.152904 -2.603444
H -0.212902 3.798156 0.460720
H 0.269900 3.135345 2.078122
H -3.120902 0.369331 0.910005
H -4.034702 1.598805 -0.011298
H 3.175794 1.011745 -0.654994
H 4.148150 1.384463 0.798109
H -1.314681 1.407953 1.829213
H 1.337913 2.351273 -0.583603
H -2.362131 -0.712467 -1.215123
H -3.158459 0.584387 -2.181813
H 3.410472 -0.828902 1.827369
H 2.550489 -1.219393 0.291900
H -5.080351 -4.299360 -0.091905
H -6.357537 -3.079500 -0.429872
H -5.747132 -3.333596 1.245847
H 5.185828 -3.103678 -3.029594
H 6.484421 -2.343924 -2.044794
H 5.765515 -1.474411 -3.449374


