%chk=000215441.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215441

0 1
S -6.015794 -0.768521 -1.338149
O 1.489803 0.023180 -2.004197
N -2.357502 0.134496 -0.094631
C 1.432541 -0.088200 -0.559980
C -0.000031 -0.571079 -0.171193
C 2.539918 -1.033211 -0.100707
C 1.731729 1.315148 -0.046369
C -1.040780 0.462993 -0.664657
C -0.291516 -1.957679 -0.748052
C 2.454035 -1.736626 1.108117
C 2.047850 2.344446 -0.943413
C 3.687662 -1.165220 -0.896452
C 1.701255 1.578479 1.331183
C 3.498796 -2.575694 1.507315
C 2.325203 3.628679 -0.466675
C 4.729235 -2.005376 -0.496356
C 1.978395 2.864035 1.803035
C 4.635949 -2.714177 0.705838
C 2.289730 3.891230 0.905999
C -3.364056 -0.086569 -0.880037
C -4.661032 -0.396442 -0.292432
C -5.053382 -0.456678 1.014289
C -6.446494 -0.803292 1.178356
C -7.100813 -1.003651 0.002216
H -0.065738 -0.625196 0.945591
H -0.774182 1.479656 -0.279293
H -1.002538 0.534311 -1.773998
H 0.452828 -2.698013 -0.430010
H -0.315059 -1.954508 -1.843035
H -1.270175 -2.321263 -0.405003
H 1.298398 -0.847011 -2.414087
H 1.575080 -1.636256 1.744150
H 2.076690 2.135376 -2.015934
H 3.763095 -0.596948 -1.826375
H 1.467174 0.784428 2.038176
H 3.425853 -3.120727 2.446907
H 2.570406 4.424559 -1.167634
H 5.616756 -2.103363 -1.119255
H 1.952740 3.065025 2.872570
H 5.447838 -3.367893 1.018456
H 2.505303 4.891391 1.276361
H -3.340700 -0.059829 -1.983995
H -4.396753 -0.265225 1.856138
H -6.895063 -0.886732 2.159802
H -8.131654 -1.268752 -0.156282


%chk=000215441-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215441

0 1
S -6.113289 -0.309519 -1.449030
O 1.481964 -0.116696 -2.061137
N -2.358634 0.065418 0.055069
C 1.454937 -0.149078 -0.575630
C 0.021836 -0.598968 -0.111514
C 2.581744 -1.088978 -0.077789
C 1.760300 1.293358 -0.121199
C -1.044392 0.467624 -0.478712
C -0.376850 -1.975385 -0.693432
C 2.470633 -1.893260 1.084667
C 1.858937 2.351286 -1.056537
C 3.807841 -1.102159 -0.794178
C 1.929176 1.575853 1.258094
C 3.552678 -2.694613 1.515292
C 2.118674 3.670239 -0.618324
C 4.888825 -1.901358 -0.366041
C 2.181107 2.893985 1.695812
C 4.766313 -2.703625 0.792493
C 2.277010 3.948941 0.758054
C -3.388454 0.064236 -0.750768
C -4.723768 -0.295624 -0.280987
C -5.152783 -0.654377 0.996814
C -6.558389 -0.940971 1.077287
C -7.222811 -0.805230 -0.135912
H 0.024310 -0.665922 0.993781
H -0.772604 1.423720 0.007848
H -1.042568 0.631897 -1.581627
H 0.400959 -2.740428 -0.524314
H -0.573459 -1.906521 -1.781622
H -1.309948 -2.324408 -0.219518
H 1.406888 -1.051402 -2.380390
H 1.539644 -1.909209 1.661432
H 1.735954 2.127475 -2.119131
H 3.903896 -0.471109 -1.683914
H 1.882301 0.764660 1.993780
H 3.445109 -3.311730 2.414592
H 2.195524 4.479806 -1.353344
H 5.827724 -1.894875 -0.931430
H 2.310164 3.096255 2.765135
H 5.604538 -3.324779 1.127469
H 2.476932 4.971891 1.096472
H -3.298914 0.337473 -1.825476
H -4.456955 -0.698315 1.837053
H -7.064516 -1.235654 1.999720
H -8.276584 -0.956623 -0.362611


