%chk=000264539.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264539

0 1
S 3.694184 -0.379673 -1.532187
O -1.548496 1.978876 -1.960253
O -3.994352 -0.176024 1.315099
N 0.677693 -0.106796 -1.426710
N -1.904530 -1.032803 0.877185
N -2.771315 0.906012 -0.327477
N 0.400369 -1.730698 0.171592
C 4.364025 0.275330 0.083557
C -0.592844 0.085183 -0.857301
C -0.739007 -0.935414 0.123312
C 1.244806 -1.200416 -0.783374
C 2.582061 -1.741775 -1.098696
C 5.146960 -0.837657 0.759179
C 5.261761 1.410803 -0.389726
C 3.209411 0.767616 0.936434
C -1.599311 1.077938 -1.148362
C -2.969589 -0.100119 0.664192
C -2.055215 -2.106444 1.888764
C -3.906758 1.852224 -0.512557
H 2.976452 -2.350042 -0.252859
H 2.542526 -2.433996 -1.971729
H 1.083175 0.488391 -2.135156
H 5.924427 -1.257053 0.106263
H 5.656140 -0.469603 1.660992
H 4.506933 -1.668771 1.081269
H 4.706454 2.192718 -0.926011
H 6.065090 1.065900 -1.055445
H 5.749827 1.902485 0.463224
H 2.549927 -0.045696 1.269655
H 3.573980 1.262667 1.847412
H 2.580734 1.499822 0.412653
H -3.047531 -2.034999 2.374595
H -1.270635 -2.016129 2.660726
H -1.960606 -3.097894 1.410767
H -3.654909 2.594506 -1.293723
H -4.121946 2.383735 0.430452
H -4.816288 1.306597 -0.817959


%chk=000264539-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000264539

0 1
S 3.750508 -0.476740 -1.612661
O -1.510925 2.088645 -1.860156
O -4.182096 -0.259341 1.247623
N 0.634081 -0.094002 -1.288559
N -2.034055 -1.104642 0.822240
N -2.837290 0.887246 -0.293556
N 0.275008 -1.775143 0.201192
C 4.474071 0.298510 0.024241
C -0.657021 0.094233 -0.789606
C -0.848737 -0.959375 0.118280
C 1.160832 -1.214409 -0.673497
C 2.519807 -1.766992 -0.984315
C 5.255398 -0.785353 0.793576
C 5.424793 1.395179 -0.505667
C 3.346518 0.904379 0.883894
C -1.637783 1.110033 -1.062096
C -3.082055 -0.169457 0.631394
C -2.215219 -2.224204 1.766062
C -3.951200 1.848422 -0.464539
H 2.921489 -2.284792 -0.099203
H 2.465451 -2.507237 -1.802950
H 1.140986 0.513189 -1.936390
H 6.042996 -1.230956 0.162256
H 5.734496 -0.334415 1.684578
H 4.594845 -1.595177 1.152448
H 4.875807 2.160350 -1.082548
H 6.212701 0.967669 -1.151232
H 5.916701 1.896468 0.349154
H 2.639463 0.134683 1.241343
H 3.788695 1.390519 1.775836
H 2.778415 1.668493 0.325084
H -3.225627 -2.139833 2.191498
H -1.458826 -2.171131 2.567062
H -2.102265 -3.185787 1.237931
H -3.622299 2.602052 -1.194911
H -4.193085 2.323078 0.500378
H -4.850971 1.324638 -0.826386


