%chk=000256110.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256110

0 1
S -0.635692 0.829805 1.891456
O -1.475729 -1.144005 0.326599
N -2.938066 0.672870 0.644797
N -4.112077 -0.926015 -0.750094
N -5.101555 1.220835 -0.105898
C 4.341643 0.365204 0.261894
C 5.635749 -0.459682 0.250551
C 3.232994 -0.344851 1.050027
C 6.745191 0.250369 -0.536559
C 1.938489 0.483957 1.058209
C 8.040697 -0.573320 -0.549344
C 0.849511 -0.227588 1.846161
C 9.148293 0.128369 -1.332160
C -1.758768 -0.083442 0.796777
C -4.075515 0.286363 -0.102050
C -5.245917 -1.209490 -1.441264
C -6.213070 0.895259 -0.807826
C -6.330805 -0.322186 -1.499132
H 4.005820 0.551025 -0.777034
H 4.536150 1.363856 0.698703
H 5.442438 -1.457335 -0.189270
H 5.972305 -0.647893 1.288299
H 3.570539 -0.532478 2.087541
H 3.038963 -1.342396 0.608842
H 6.940252 1.248356 -0.099224
H 6.410973 0.438407 -1.575067
H 2.141300 1.487646 1.484413
H 1.606031 0.663705 0.014349
H 8.378141 -0.760542 0.488847
H 7.847623 -1.571517 -0.988984
H 0.599138 -1.215195 1.397638
H 1.148367 -0.417471 2.895447
H 8.861528 0.294039 -2.376896
H 10.068656 -0.466222 -1.335291
H 9.390884 1.106055 -0.900555
H -3.019327 1.597018 1.104413
H -5.260193 -2.181414 -1.953916
H -7.020341 1.640148 -0.805901
H -7.228917 -0.566544 -2.057098


%chk=000256110-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256110

0 1
S -0.811018 0.781372 2.490666
O -1.119577 -1.014766 0.398006
N -2.883234 0.524557 0.796221
N -3.676466 -0.815717 -1.035697
N -4.957482 1.045224 -0.086343
C 4.180082 0.338294 0.382684
C 5.520746 -0.427593 0.315458
C 3.174339 -0.277320 1.382205
C 6.522812 0.184481 -0.689165
C 1.833250 0.494827 1.424335
C 7.862388 -0.583696 -0.763577
C 0.840786 -0.140819 2.409447
C 8.856799 0.034278 -1.770265
C -1.637914 -0.072203 1.025270
C -3.862110 0.213017 -0.161067
C -4.693482 -1.022743 -1.922577
C -5.948272 0.805007 -0.987057
C -5.865403 -0.233970 -1.944869
H 3.721464 0.361727 -0.627556
H 4.375401 1.395043 0.661147
H 5.324484 -1.484739 0.038910
H 5.981841 -0.450873 1.325235
H 3.628064 -0.295275 2.395332
H 2.982195 -1.333869 1.103099
H 6.723002 1.241029 -0.412435
H 6.061277 0.210550 -1.698569
H 2.019931 1.549773 1.705830
H 1.382775 0.502090 0.413692
H 8.323271 -0.610121 0.245103
H 7.661219 -1.638819 -1.040562
H 0.589159 -1.173553 2.111698
H 1.214369 -0.136224 3.447829
H 8.430243 0.046775 -2.791175
H 9.804114 -0.534688 -1.806918
H 9.099935 1.078602 -1.496901
H -3.151403 1.315149 1.392344
H -4.544552 -1.849528 -2.625684
H -6.820132 1.465390 -0.929044
H -6.667197 -0.416968 -2.663648


