%chk=000249776.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249776

0 1
S -0.691676 3.016939 0.332978
S 1.280109 2.770275 -0.213652
N -1.746518 0.484335 0.384079
N 1.661110 0.055272 -0.327427
N -2.523634 0.301782 -1.743039
N 2.360475 -0.367609 1.792461
N -1.961259 1.493873 -1.616900
N 2.117854 0.930504 1.696073
C -2.429462 -0.373556 -0.535246
C 2.102405 -0.968678 0.569417
C -1.474756 1.665440 -0.349526
C 1.694319 1.249145 0.434550
C -1.461815 0.084378 1.693263
C 1.288565 -0.228912 -1.644785
C -2.851974 -1.660146 -0.096334
C 2.187527 -2.309590 0.099120
C -1.871381 -1.163711 2.084688
C 1.370741 -1.530430 -2.066667
C -2.573923 -2.037887 1.190211
C 1.826961 -2.574497 -1.195104
H -0.918118 0.788141 2.337494
H 0.942230 0.604311 -2.270656
H -3.385291 -2.295336 -0.806373
H 2.540939 -3.075408 0.792424
H -1.659598 -1.511900 3.098622
H 1.080931 -1.789898 -3.087860
H -2.881921 -3.016216 1.564616
H 1.878958 -3.589823 -1.593325


%chk=000249776-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249776

0 1
S -0.906181 3.149065 0.231066
S 1.531188 2.847519 -0.110070
N -1.725005 0.467794 0.370447
N 1.643478 0.049963 -0.315427
N -2.294445 0.030299 -1.799202
N 2.099820 -0.566644 1.837397
N -1.859084 1.348795 -1.716066
N 2.012804 0.820512 1.786471
C -2.217546 -0.508262 -0.526054
C 1.878144 -1.039314 0.555038
C -1.516219 1.635205 -0.415836
C 1.744734 1.214088 0.496640
C -1.521031 0.208503 1.716432
C 1.369057 -0.118028 -1.663295
C -2.541062 -1.801614 -0.038029
C 1.854805 -2.361288 0.037455
C -1.825082 -1.057598 2.197609
C 1.332668 -1.408827 -2.172752
C -2.344351 -2.070447 1.319048
C 1.582601 -2.540117 -1.321345
H -1.115906 1.024480 2.319410
H 1.180968 0.787714 -2.244508
H -2.935114 -2.542376 -0.737476
H 2.051794 -3.193700 0.716793
H -1.654007 -1.270877 3.255094
H 1.102192 -1.547830 -3.231289
H -2.583608 -3.058695 1.722535
H 1.556185 -3.547523 -1.746985


