%chk=000286191.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286191

0 1
S -0.002188 2.539472 0.452585
S 5.150345 -1.695127 -3.718183
S -5.152045 -1.705814 -3.710504
O 4.655386 -1.052999 0.252491
O -4.647455 -1.069276 0.259850
O -0.004611 3.310363 -0.776576
O -0.002216 3.205229 1.748518
N 3.443379 -0.304509 -2.058941
N -3.445081 -0.312168 -2.053802
C 1.369614 1.470974 0.421083
C -1.370260 1.466154 0.423311
C 1.864867 1.013837 -0.802644
C -1.867534 1.009499 -0.799782
C 1.991036 1.113037 1.619910
C -1.986823 1.103813 1.623318
C 3.595600 -0.221525 0.409571
C -3.590193 -0.234292 0.415305
C 2.973075 0.156507 -0.826310
C -2.972730 0.148250 -0.821730
C 3.099262 0.264034 1.626478
C -3.091972 0.250822 1.631622
C 5.404335 -1.489772 1.442345
C -5.391214 -1.511013 1.451126
C 6.492229 -2.366756 0.827573
C -6.477676 -2.390911 0.837986
C 7.404428 -2.931682 1.908169
C -7.384624 -2.961089 1.920242
C 4.253747 -0.944518 -2.674666
C -4.254998 -0.953942 -2.668282
H 1.406671 1.329315 -1.750019
H -1.413280 1.328403 -1.747930
H 1.613910 1.511214 2.571640
H -1.608339 1.501619 2.574647
H 3.569276 -0.002845 2.569207
H -3.558218 -0.019464 2.575250
H 4.716670 -2.046674 2.098863
H 5.802685 -0.595854 1.949297
H -5.791362 -0.619507 1.960902
H -4.699534 -2.066555 2.104571
H 7.076470 -1.777848 0.088540
H 6.027438 -3.185140 0.237765
H -6.011613 -3.206541 0.245373
H -7.066238 -1.802855 0.101708
H 8.187123 -3.561949 1.464254
H 6.857827 -3.556588 2.624368
H 7.912815 -2.141079 2.473109
H -8.166289 -3.593457 1.477501
H -7.894262 -2.173358 2.488058
H -6.833634 -3.585232 2.633738


%chk=000286191-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000286191

0 1
S -0.002126 2.477571 0.396003
S 5.428769 -1.337729 -4.101439
S -5.435681 -1.345052 -4.091973
O 4.924762 -1.045819 0.188441
O -4.916852 -1.063119 0.196057
O -0.005093 3.291687 -1.024325
O -0.002050 3.203307 1.864803
N 3.770789 -0.195012 -2.105015
N -3.773812 -0.201876 -2.098999
C 1.510742 1.343436 0.365251
C -1.510800 1.337810 0.367758
C 2.046974 0.994889 -0.881083
C -2.050026 0.990729 -0.877684
C 2.076679 0.959116 1.588832
C -2.071066 0.948008 1.592218
C 3.797432 -0.252112 0.329048
C -3.791795 -0.265902 0.334979
C 3.203599 0.180656 -0.909704
C -3.203818 0.172440 -0.904598
C 3.232400 0.148305 1.564030
C -3.223875 0.133020 1.569130
C 5.622168 -1.516815 1.409189
C -5.608470 -1.539844 1.417869
C 6.813832 -2.356496 0.946289
C -6.799372 -2.381542 0.956672
C 7.619113 -2.898373 2.147938
C -7.598790 -2.929386 2.159537
C 4.502809 -0.700244 -2.928326
C -4.507011 -0.707301 -2.921148
H 1.607288 1.365072 -1.812221
H -1.614770 1.365144 -1.809219
H 1.644017 1.311047 2.530725
H -1.636508 1.298843 2.533640
H 3.690717 -0.160104 2.507023
H -3.677769 -0.179748 2.512831
H 4.918757 -2.118871 2.020417
H 5.954460 -0.638035 1.998962
H -5.941201 -0.663856 2.011533
H -4.901093 -2.141705 2.024694
H 7.459841 -1.734841 0.299658
H 6.443804 -3.191295 0.323270
H -6.429210 -3.213367 0.329771
H -7.449478 -1.759760 0.314283
H 8.477694 -3.497510 1.798689
H 6.997816 -3.547401 2.793291
H 8.015917 -2.076597 2.773038
H -8.456874 -3.529966 1.811544
H -7.995736 -2.110654 2.788523
H -6.973306 -3.578542 2.800705


