%chk=000263258.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000263258

0 1
S 4.426822 -0.763106 1.120504
O 3.987055 -2.131455 0.917494
O 4.963779 -0.362461 2.407982
O -5.013627 3.091065 -0.080290
O -2.936919 3.092905 0.504686
O -6.395183 -2.836402 -1.009855
O -7.388924 -0.915802 -1.110665
N -1.586880 0.899204 0.692693
N -0.470196 0.115157 0.923374
N -3.972518 2.512873 0.162404
N -6.416180 -1.621464 -0.901799
C 3.038376 0.301563 0.782964
C 1.824212 -0.187054 1.565279
C 5.555699 -0.336954 -0.123492
C 6.500771 0.667269 0.106376
C 5.544772 -1.025835 -1.340119
C 0.630425 0.695397 1.304793
C 7.415664 1.007721 -0.894315
C 6.458507 -0.687576 -2.342481
C -2.760941 0.279396 0.304616
C 7.391498 0.331388 -2.119223
C -3.934270 1.063202 0.044286
C -2.845226 -1.143556 0.150410
C -5.130335 0.422141 -0.350576
C -5.172084 -0.956819 -0.488976
C -4.013235 -1.747489 -0.233907
H 3.275732 1.350891 1.048037
H 2.801971 0.330745 -0.299211
H 2.027939 -0.183145 2.663180
H 1.602029 -1.253994 1.308226
H 6.536826 1.178989 1.074681
H 4.831228 -1.840961 -1.505670
H 0.791311 1.771141 1.468762
H 8.151796 1.790891 -0.716873
H 6.450265 -1.222814 -3.291318
H 8.106695 0.594689 -2.900218
H -1.563385 1.943898 0.806427
H -1.949040 -1.744513 0.349331
H -6.031554 1.032136 -0.548433
H -4.083574 -2.837862 -0.352583


%chk=000263258-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000263258

0 1
S 4.494747 -0.707418 1.152595
O 4.146746 -2.305076 1.061226
O 5.014895 -0.005798 2.539545
O -5.156212 3.146752 0.158109
O -2.981245 3.092190 0.827383
O -6.447837 -2.813023 -1.319185
O -7.499465 -0.783982 -1.281207
N -1.669461 0.840568 0.831887
N -0.546648 0.045114 1.033251
N -4.068590 2.499698 0.383239
N -6.468438 -1.539373 -1.093514
C 2.857479 0.234347 0.672439
C 1.789838 -0.147989 1.712566
C 5.726675 -0.288623 -0.228696
C 6.564297 0.823838 -0.048418
C 5.784052 -1.150224 -1.335921
C 0.532153 0.648370 1.474862
C 7.500829 1.106011 -1.070866
C 6.726993 -0.849627 -2.346849
C -2.837409 0.270076 0.370349
C 7.574901 0.276160 -2.215152
C -4.027059 1.056398 0.139849
C -2.906957 -1.135805 0.099384
C -5.214638 0.460405 -0.338342
C -5.229817 -0.915282 -0.590363
C -4.078227 -1.722556 -0.372436
H 3.149428 1.296841 0.693501
H 2.618624 -0.106077 -0.347176
H 2.183688 0.067133 2.725772
H 1.569136 -1.226498 1.643928
H 6.505828 1.421786 0.867397
H 5.140090 -2.034754 -1.387204
H 0.567546 1.736811 1.678720
H 8.174202 1.963151 -0.968025
H 6.804908 -1.497245 -3.226157
H 8.305509 0.499334 -3.000053
H -1.704892 1.866707 1.009942
H -2.007284 -1.727334 0.277639
H -6.104217 1.072577 -0.507026
H -4.134869 -2.794185 -0.580491


