%chk=000290638.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290638

0 1
S 1.129308 -1.794498 0.006523
S -2.408237 -2.439402 0.004019
O 1.107800 -2.519781 -1.243888
O 1.104898 -2.513354 1.260581
N -0.232418 -0.734583 0.002214
C -3.841679 -0.214115 -0.003396
C -2.492073 0.206200 -0.002918
C -4.070686 -1.687870 0.000209
C -1.489331 -0.874164 0.001062
C 2.426839 -0.663465 0.005121
C -4.868475 0.731362 -0.007089
C -2.175686 1.568256 -0.006119
C -4.544253 2.093940 -0.010286
C -3.209364 2.511251 -0.009810
C 2.956209 -0.202837 1.216035
C 2.959239 -0.209340 -1.206934
C 4.545418 1.171807 0.002845
C 4.010564 0.710174 1.218549
C 4.013594 0.703640 -1.211711
C 5.682930 2.137185 0.001566
H -4.634668 -2.024994 0.892721
H -4.632712 -2.029680 -0.891750
H -5.909694 0.416142 -0.007487
H -1.128992 1.881581 -0.005710
H -5.343487 2.836032 -0.013179
H -2.971622 3.573903 -0.012320
H 2.548383 -0.566590 2.166498
H 2.553776 -0.578200 -2.156440
H 4.420341 1.061808 2.163299
H 4.425758 1.050210 -2.157294
H 5.681717 2.791731 0.884255
H 6.645609 1.601187 0.001086
H 5.680295 2.790766 -0.881852


%chk=000290638-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000290638

0 1
S 1.026538 -1.630017 0.005679
S -2.249078 -2.386356 0.004327
O 0.986113 -2.442266 -1.410089
O 0.983019 -2.435424 1.425256
N -0.323484 -0.261998 0.000961
C -3.983331 -0.249459 -0.003338
C -2.682906 0.313315 -0.003212
C -4.041067 -1.761200 0.000609
C -1.572543 -0.670223 0.000895
C 2.534694 -0.510658 0.004639
C -5.113044 0.597344 -0.006989
C -2.493878 1.717369 -0.006792
C -4.929837 1.998569 -0.010527
C -3.625245 2.556534 -0.010429
C 3.076553 -0.127975 1.240536
C 3.079902 -0.134744 -1.231878
C 4.822728 1.100195 0.003323
C 4.230980 0.685699 1.226037
C 4.234287 0.678975 -1.218713
C 6.082403 1.946856 0.002645
H -4.538338 -2.160524 0.900318
H -4.536302 -2.165346 -0.898068
H -6.123250 0.173151 -0.007121
H -1.476538 2.119742 -0.006575
H -5.803341 2.659689 -0.013379
H -3.499525 3.644347 -0.013173
H 2.622324 -0.470008 2.175845
H 2.628174 -0.481888 -2.166518
H 4.677246 1.000974 2.176086
H 4.683134 0.989035 -2.169266
H 6.139090 2.592411 0.896205
H 6.985445 1.306161 0.002375
H 6.138379 2.592020 -0.891267


