%chk=000226637.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226637

0 1
 O   -1.703600      -1.734600     -7.3000002E-03
 O    3.028100       2.541300      4.3000001E-03
 O   0.8399000       2.365000      2.4999999E-03
 N  -0.3219000      0.1631000     -6.9999998E-04
 N   -3.909000     -7.7399999E-02 -5.4000001E-03
 N   -2.601700      0.3980000     -1.7000000E-03
 N    1.982600       1.850400      3.0000000E-03
 C   0.9796000     -0.3899000     -1.2000001E-03
 C    2.096900      0.4317000      1.8000000E-03
 C    1.105400      -1.771500     -4.1000000E-03
 C    3.369000     -0.1409000      2.0999999E-03
 C   -1.543800     -0.5159000     -3.0000000E-03
 C    2.377400      -2.344000     -4.1000000E-03
 C    3.509200      -1.528700     -1.1000000E-03
 C   -4.609500      0.4022000      -1.194900    
 C   -4.598600      0.3512000       1.209800    
 H  -0.3975000       1.173300      2.2000000E-03
 H   0.2885000      -2.476300     -6.5000001E-03
 H    4.275600      0.4587000      4.1999999E-03
 H   -2.446000       1.401300      3.5999999E-03
 H    2.488500      -3.424500     -6.3999998E-03
 H    4.499300      -1.975100     -1.1000000E-03
 H   -5.628700      1.4000000E-03  -1.229200    
 H   -4.103100      5.6200001E-02  -2.103500    
 H   -4.666600       1.496600      -1.231300    
 H   -4.084200     -3.3100002E-02   2.098300    
 H   -5.617600     -5.0400000E-02   1.236300    
 H   -4.654500       1.443100       1.293100    


%chk=000226637-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000226637

0 1
O -1.745166 -1.757515 -0.008813
O 3.145150 2.553514 0.020255
O 0.875022 2.461054 0.017556
N -0.326870 0.153374 0.002678
N -3.970962 0.021638 0.002792
N -2.623576 0.431603 0.004325
N 2.054110 1.868199 0.014363
C 0.940236 -0.425595 -0.001257
C 2.121561 0.408067 0.004378
C 1.141852 -1.841634 -0.010977
C 3.424546 -0.160324 0.000375
C -1.585526 -0.509910 -0.001374
C 2.434757 -2.382518 -0.014858
C 3.587477 -1.549135 -0.009254
C -4.674160 0.399533 -1.241697
C -4.670634 0.377039 1.255985
H -0.280863 1.192784 0.009747
H 0.256902 -2.480405 -0.015133
H 4.279451 0.520407 0.004948
H -2.402831 1.440886 0.011636
H 2.551344 -3.471759 -0.022350
H 4.590476 -1.985592 -0.012417
H -5.680020 -0.054276 -1.229423
H -4.122053 -0.003486 -2.105596
H -4.789032 1.504206 -1.368831
H -4.115306 -0.040405 2.110920
H -5.675996 -0.077733 1.239036
H -4.786189 1.479182 1.402685


