%chk=000163051.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163051

0 1
 O    1.994500     -0.2437000     -0.9535000    
 O    1.792800       2.731900      0.4007000    
 O    2.627600     -0.3910000       1.973400    
 O    4.399000      -1.498500      -1.628700    
 N  -0.2268000     -0.1596000     -0.1284000    
 N   -1.904900       1.479100     -0.6896000    
 N   -4.176400      0.6747000     -0.3422000    
 N   -4.651800      -1.518400      0.4730000    
 C   0.9674000      0.6264000     -0.4446000    
 C    1.542900       1.375500      0.7611000    
 C    2.852500      0.6649000       1.047800    
 C    3.234500      0.1079000     -0.3184000    
 C    4.148200      -1.103900     -0.2967000    
 C   -1.524600      0.2655000     -0.2539000    
 C  -0.2159000      -1.449000      0.3437000    
 C   -2.358500     -0.7717000      0.1455000    
 C   -1.521800      -1.853200      0.5225000    
 C   -3.730000     -0.5281000      8.8000000E-02
 C   -3.248800       1.591200     -0.6995000    
 H   0.6915000       1.306900      -1.258800    
 H   0.8620000       1.388300       1.618200    
 H    3.636500       1.316200       1.446800    
 H    3.679400      0.8952000     -0.9404000    
 H    3.688100      -1.955100      0.2151000    
 H    5.101500     -0.8721000      0.1871000    
 H   0.7104000      -1.979000      0.5192000    
 H    2.386200       2.741000     -0.3692000    
 H    2.341800      1.1700000E-02   2.811000    
 H   -1.830400      -2.823700      0.8862000    
 H    3.542800      -1.699300      -2.043900    
 H   -3.638800       2.544400      -1.039600    
 H   -4.333300      -2.421600      0.7960000    
 H   -5.640800      -1.315300      0.4211000    


%chk=000163051-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000163051

0 1
O 1.903423 0.667606 -1.052750
O 2.324051 2.946821 0.935303
O 2.890648 -0.590232 1.968658
O 3.248004 -1.643707 -2.072955
N -0.112405 0.179499 0.288437
N -1.837076 1.294693 -1.063470
N -3.996747 0.139135 -1.075353
N -4.411849 -1.852572 0.083909
C 0.939587 1.141494 -0.029101
C 1.856318 1.571498 1.141738
C 3.068707 0.585973 1.098947
C 3.137086 0.122836 -0.380041
C 3.203446 -1.392853 -0.630920
C -1.401826 0.287585 -0.253692
C -0.064307 -0.989686 1.079730
C -2.169610 -0.825161 0.207130
C -1.305111 -1.622084 1.050084
C -3.524368 -0.856329 -0.254997
C -3.141750 1.147809 -1.428158
H 0.419186 2.001501 -0.484004
H 1.347307 1.584114 2.117695
H 3.977146 1.142849 1.395284
H 3.979968 0.598117 -0.913200
H 2.346078 -1.906259 -0.158067
H 4.137201 -1.811411 -0.223006
H 0.854076 -1.256668 1.600587
H 2.593732 3.056172 -0.014290
H 3.080766 -0.331522 2.904383
H -1.544253 -2.543504 1.579061
H 2.454832 -1.201097 -2.474016
H -3.557642 1.921708 -2.079724
H -4.141280 -2.630565 0.677831
H -5.356541 -1.798160 -0.292034


