%chk=000182993.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182993

0 1
S -5.865117 -0.388556 -0.699595
O 0.683277 -1.378008 -0.161073
O 0.672704 0.621836 -1.324286
O 0.532986 0.628865 0.984255
C 2.675348 0.039908 -0.043911
C 4.232216 0.102518 0.050506
C 2.133828 -1.409115 -0.072847
C 2.122546 0.724846 -1.316336
C 1.973456 0.731009 1.149298
C 0.135185 -0.062900 -0.197336
C 4.865293 -0.602082 -1.164101
C 4.702921 1.568976 0.075030
C 4.713747 -0.595431 1.336410
C -1.359629 -0.116956 -0.298237
C -1.973869 -1.201715 -0.944074
C -2.130731 0.918275 0.244366
C -3.364010 -1.248901 -1.046216
C -3.525277 0.873102 0.143149
C -4.128505 -0.207563 -0.500993
C -6.616470 1.058464 0.070765
H 2.459576 -1.977994 -0.959415
H 2.348575 -1.972841 0.850344
H 2.330215 1.807051 -1.353994
H 2.446817 0.236215 -2.250101
H 2.182138 0.245818 2.117421
H 2.176350 1.813265 1.206078
H 4.577038 -0.133566 -2.110822
H 5.960087 -0.564346 -1.112686
H 4.587877 -1.659756 -1.219930
H 4.304242 2.117239 0.934757
H 4.410356 2.112434 -0.829368
H 5.795977 1.628865 0.140567
H 4.429846 -1.652529 1.364668
H 5.806857 -0.559105 1.416543
H 4.314733 -0.121271 2.239035
H -1.355852 -2.003147 -1.356573
H -1.636705 1.752319 0.748580
H -3.840989 -2.091755 -1.547324
H -4.113558 1.682475 0.569017
H -6.308738 1.992717 -0.412455
H -6.397086 1.118968 1.142784
H -7.705257 0.958672 -0.047101


%chk=000182993-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182993

0 1
S -6.028700 -0.494306 -0.507327
O 0.734811 -1.422767 -0.498415
O 0.614604 0.879565 -1.121897
O 0.535195 0.264859 1.181173
C 2.680422 0.040145 -0.039187
C 4.254393 0.139392 0.039292
C 2.159539 -1.426963 -0.057370
C 2.084864 0.707830 -1.313812
C 1.957856 0.720866 1.159300
C 0.124926 -0.138193 -0.172780
C 4.895194 -0.244223 -1.325553
C 4.696057 1.588534 0.393811
C 4.810719 -0.821528 1.129235
C -1.375709 -0.220965 -0.247483
C -2.032814 -1.431050 -0.566416
C -2.141542 0.939656 0.002382
C -3.438582 -1.479551 -0.636076
C -3.550040 0.899070 -0.066138
C -4.207116 -0.313214 -0.387235
C -6.637677 1.234376 -0.108417
H 2.689233 -2.056100 -0.792669
H 2.216021 -1.892124 0.944107
H 2.479242 1.724410 -1.482276
H 2.253486 0.087334 -2.213415
H 2.376917 0.417491 2.133875
H 1.975407 1.822952 1.070448
H 4.637418 0.480704 -2.118710
H 5.996710 -0.251487 -1.229468
H 4.585097 -1.248933 -1.666385
H 4.376939 1.881011 1.410700
H 4.296641 2.333558 -0.318524
H 5.799164 1.657153 0.361720
H 4.640079 -1.882091 0.869750
H 5.902594 -0.677687 1.227744
H 4.359945 -0.634248 2.121035
H -1.437471 -2.328079 -0.755607
H -1.633458 1.876100 0.252331
H -3.938704 -2.422863 -0.882529
H -4.117428 1.813186 0.132565
H -6.266731 1.959808 -0.849260
H -6.339603 1.527620 0.910326
H -7.735500 1.177052 -0.168045


