%chk=000290952.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290952

0 1
S -1.455833 1.383395 0.513916
N 2.607653 0.142376 0.410293
N 1.230264 0.355409 0.254740
C 0.394855 -0.641198 0.138481
C -1.014401 -0.250628 0.090835
C 0.691916 -2.108054 0.045305
C -2.127443 -0.967271 -0.253150
C 3.281826 -0.305685 -0.854741
C 3.202795 1.440673 0.876617
C -3.342454 -0.196542 -0.169597
C -3.141451 1.090561 0.234099
H 0.654119 -2.460348 -0.993416
H 1.687116 -2.347275 0.452332
H -0.030262 -2.701956 0.623463
H -2.129565 -2.002556 -0.562213
H 2.855312 -1.260353 -1.195349
H 3.210031 0.415313 -1.683317
H 4.346701 -0.479836 -0.633506
H 3.147410 2.259462 0.144443
H 2.674188 1.772248 1.787361
H 4.254354 1.258999 1.142466
H -4.304315 -0.627469 -0.410271
H -3.875515 1.864136 0.377210


%chk=000290952-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000290952

0 1
S -1.538839 1.537074 0.340755
N 2.615444 0.175139 0.390544
N 1.220083 0.432787 0.353781
C 0.369258 -0.561606 0.114256
C -1.043303 -0.191107 0.072668
C 0.737022 -2.028665 -0.030118
C -2.165489 -0.992211 -0.154887
C 3.252853 -0.331972 -0.854734
C 3.310042 1.369803 0.924033
C -3.415656 -0.279241 -0.108678
C -3.263046 1.075399 0.145865
H 0.886608 -2.329872 -1.084768
H 1.670614 -2.225867 0.526988
H -0.059905 -2.666731 0.386287
H -2.101257 -2.064321 -0.356363
H 2.837781 -1.303491 -1.157534
H 3.127167 0.385684 -1.696927
H 4.331120 -0.465519 -0.662735
H 3.320706 2.212422 0.197647
H 2.793937 1.701615 1.836468
H 4.349622 1.097215 1.176788
H -4.387294 -0.756136 -0.259768
H -4.030169 1.843003 0.236434


