%chk=000282203.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282203

0 1
S -1.199381 1.331597 -0.209496
O -1.043140 1.683661 -1.604491
O -1.225728 2.378464 0.786047
N 2.180684 0.181516 0.055551
C -1.450208 -1.013021 -0.062682
C -0.250515 -0.087354 0.293360
C -2.543882 0.090110 0.015141
C 1.015851 -0.667732 -0.323772
C -1.352156 -2.268070 0.795951
C -3.224356 0.229060 1.358508
C -3.530925 0.066598 -1.130144
C 1.086405 -2.125828 0.135994
C 0.048284 -2.817758 0.626495
C 3.319803 0.074564 -0.913536
C 2.629273 -0.006091 1.473868
C 2.958219 0.773980 -2.223822
C 3.211682 1.307499 1.997109
H -1.384671 -1.354610 -1.130532
H -0.079826 -0.022028 1.398340
H 0.933997 -0.658450 -1.447707
H -2.108260 -3.017852 0.494292
H -1.548055 -2.055225 1.865518
H -2.516131 0.239012 2.197199
H -3.801873 1.162895 1.425676
H -3.925241 -0.597598 1.533836
H -4.105597 -0.868433 -1.143674
H -4.258177 0.886874 -1.058062
H -3.041365 0.165890 -2.111566
H 2.068895 -2.581368 0.031654
H 0.160724 -3.856291 0.937599
H 4.203358 0.581651 -0.463080
H 3.620317 -0.977434 -1.107328
H 1.751469 -0.291248 2.097545
H 3.369353 -0.827450 1.583201
H 2.571259 1.786969 -2.034333
H 2.173505 0.243892 -2.776576
H 3.830048 0.864918 -2.878350
H 2.503702 2.136064 1.845292
H 4.133466 1.586353 1.474779
H 3.432692 1.244874 3.066695


%chk=000282203-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000282203

0 1
S -1.174971 1.397941 -0.523375
O -0.981509 1.392085 -2.156642
O -1.099337 2.793016 0.324171
N 2.244554 0.039401 0.084782
C -1.476832 -1.032765 -0.055547
C -0.244359 -0.160983 0.260917
C -2.655530 -0.026978 0.026421
C 1.042676 -0.722446 -0.307639
C -1.405480 -2.316576 0.798250
C -3.149720 0.375627 1.408106
C -3.707548 -0.132269 -1.061846
C 1.058743 -2.214032 0.123131
C 0.001403 -2.897039 0.647477
C 3.315351 0.074334 -0.942822
C 2.700220 -0.090400 1.490184
C 3.015712 1.073678 -2.079179
C 3.207136 1.250410 2.059762
H -1.391120 -1.338541 -1.117923
H -0.167662 0.120115 1.325677
H 0.978851 -0.673246 -1.414252
H -2.156929 -3.058945 0.465464
H -1.623917 -2.103484 1.864936
H -2.343073 0.420552 2.159631
H -3.628058 1.370409 1.377082
H -3.909296 -0.350632 1.761347
H -4.200137 -1.125109 -1.022876
H -4.489701 0.638676 -0.950907
H -3.247430 -0.019426 -2.061768
H 2.032670 -2.715089 0.027651
H 0.141846 -3.939028 0.966340
H 4.253145 0.373869 -0.439675
H 3.504162 -0.940648 -1.372183
H 1.848421 -0.444469 2.101286
H 3.495881 -0.866251 1.598629
H 2.946170 2.098197 -1.675451
H 2.055280 0.855115 -2.580160
H 3.814929 1.042550 -2.843805
H 2.406028 2.008715 2.020075
H 4.063492 1.635585 1.476713
H 3.539436 1.130684 3.108517


