%chk=000299525.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299525

0 1
S 2.222936 -0.451514 -1.239383
O -4.377714 0.940639 0.270816
O -5.182536 -1.934803 -1.315450
O -7.427260 1.035126 0.319401
O 3.348622 -0.427674 -3.073171
O 5.432105 -0.321953 -3.696530
N -2.475327 -0.455294 0.392897
N -0.940384 -1.138553 -1.189754
N -0.901914 0.700814 1.957747
N 1.444730 0.573009 1.157247
N 4.372776 -0.870861 0.703776
N 0.893378 1.555836 3.249852
N 6.094898 -0.801909 -0.811623
N 4.585075 -0.438940 -2.844345
C -3.777743 -0.132860 1.014004
C -5.637990 -1.035818 -0.292531
C -4.755550 -1.316318 0.933472
C -5.302490 0.417313 -0.725654
C -6.501520 1.371048 -0.719420
C -1.225584 0.003745 0.828795
C -2.228548 -1.131718 -0.861750
C -0.267976 -0.440834 -0.165729
C 1.080374 -0.109773 0.057226
C 0.450480 0.941460 2.074867
C 3.793881 -0.624729 -0.513029
C 4.872296 -0.602215 -1.449943
C 5.790049 -0.959226 0.484174
C 3.726716 -1.041352 2.006478
H -3.606095 0.296119 2.032379
H -6.720378 -1.190532 -0.102496
H -5.357572 -1.392906 1.856165
H -4.243365 -2.296084 0.825261
H -4.761820 0.438225 -1.698179
H -7.107917 1.273494 -1.640547
H -6.165792 2.419552 -0.599982
H -5.885335 -2.107559 -1.972976
H -3.051440 -1.580612 -1.419351
H -7.037684 1.259671 1.193983
H 0.190426 2.022492 3.812429
H 1.785336 2.032872 3.208983
H 6.489914 -1.135512 1.288032
H 4.410620 -1.524695 2.724339
H 3.411748 -0.059348 2.421645
H 2.816172 -1.666122 1.923872


%chk=000299525-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299525

0 1
S 2.209704 -1.488177 -1.204447
O -4.281863 1.023100 0.194897
O -5.425750 -2.081398 -0.943363
O -7.015687 1.730557 0.480690
O 3.876141 0.165569 -3.298416
O 5.363866 1.754882 -2.586513
N -2.495628 -0.626317 0.425988
N -1.104479 -1.810032 -0.976899
N -0.807830 0.738304 1.613178
N 1.478503 0.256868 0.833791
N 4.305637 -1.219657 0.669762
N 1.067802 1.832956 2.516791
N 5.805866 0.211673 -0.262243
N 4.660424 0.691003 -2.408056
C -3.708771 -0.052577 1.027423
C -5.732296 -0.929802 -0.071934
C -4.868536 -1.058076 1.204335
C -5.300785 0.425079 -0.717550
C -6.423456 1.462513 -0.832343
C -1.197274 -0.186667 0.704947
C -2.373742 -1.599861 -0.600229
C -0.348010 -0.934133 -0.173105
C 1.030089 -0.645767 -0.062973
C 0.554137 0.915775 1.630167
C 3.767870 -0.847762 -0.569026
C 4.727393 0.026678 -1.116825
C 5.520809 -0.552494 0.808059
C 3.675165 -2.101645 1.660768
H -3.381325 0.438439 1.957159
H -6.808655 -0.918216 0.180728
H -5.459030 -0.755934 2.083951
H -4.528651 -2.095514 1.346774
H -4.834192 0.230475 -1.704983
H -7.244813 1.076441 -1.460376
H -6.028644 2.390785 -1.292118
H -6.070890 -2.119596 -1.692493
H -3.251373 -2.104969 -1.002731
H -6.280152 2.062915 1.058950
H 0.429452 2.380574 3.087328
H 2.061176 2.045922 2.485633
H 6.154387 -0.663114 1.684987
H 4.438457 -2.430117 2.383567
H 2.869271 -1.563253 2.186678
H 3.248280 -2.983733 1.156067


