%chk=000021551.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021551

0 1
 O    3.433700      -2.166700     -6.9999998E-04
 O    3.838800       2.507300      3.9999999E-04
 N   0.4797000      -1.691600       0.000000    
 N    1.699600       1.591900      1.9999999E-04
 N    3.661500      0.1717000     -3.9999999E-04
 N  -0.4232000      0.3468000      5.0000002E-04
 C    1.523500     -0.8113000     -7.9999998E-04
 C   0.9435000      0.4278000     -3.0000001E-04
 C  -0.6713000     -0.9467000      6.9999998E-04
 C   -2.010900      -1.571000      6.9999998E-04
 C    2.931000      -1.046400     -6.9999998E-04
 C    3.114500       1.505600     -6.0000003E-04
 C   0.5628000      -3.133800      1.2000001E-03
 C   -3.165500     -0.5809000      3.0000001E-04
 C    1.035400       2.889500      1.3000000E-03
 C    5.116700      6.1600000E-02   0.000000    
 C   -3.672300     -0.1464000      -1.208000    
 C   -3.673100     -0.1460000       1.208000    
 C   -4.731200      0.7614000      -1.208600    
 C   -4.732200      0.7618000       1.207400    
 C   -5.261200       1.215400     -1.0000000E-03
 H   -2.117800      -2.224100      0.8771000    
 H   -2.117600      -2.224600     -0.8754000    
 H  -0.4271000      -3.590600      2.0000001E-03
 H    1.103000      -3.445200     -0.8967000    
 H    1.103700      -3.443800      0.8993000    
 H   0.4099000       2.969500     -0.8931000    
 H    1.757200       3.710100      1.5000000E-03
 H   0.4107000       2.968400      0.8965000    
 H    5.464100     -0.9739000     -1.2000001E-03
 H    5.504800      0.5717000      0.8874000    
 H    5.505800      0.5740000     -0.8856000    
 H   -3.264000     -0.4936000      -2.152400    
 H   -3.265500     -0.4928000       2.152900    
 H   -5.142700       1.115200      -2.149400    
 H   -5.144400       1.115900       2.147800    
 H   -6.085500       1.922600     -1.4000000E-03


%chk=000021551-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000021551

0 1
O 3.582494 -2.179461 0.000210
O 3.847881 2.532606 0.000621
N 0.480422 -1.767976 0.000257
N 1.702285 1.579565 0.000297
N 3.681442 0.193244 0.000173
N -0.432512 0.327875 0.000540
C 1.549845 -0.854968 0.000145
C 0.951084 0.413463 0.000335
C -0.693872 -1.010990 0.000495
C -2.071116 -1.634208 0.000673
C 2.973977 -1.062177 0.000149
C 3.114069 1.503113 0.000051
C 0.618976 -3.232949 0.000476
C -3.200344 -0.611135 0.000235
C 1.037897 2.897040 0.000492
C 5.161643 0.149541 0.000361
C -3.732617 -0.126381 -1.219384
C -3.733122 -0.125898 1.219435
C -4.776805 0.825187 -1.222529
C -4.777312 0.825673 1.221766
C -5.303077 1.304217 -0.000582
H -2.167808 -2.293140 0.887304
H -2.167697 -2.293804 -0.885474
H -0.380165 -3.694649 0.000320
H 1.178476 -3.563696 -0.889702
H 1.178098 -3.563479 0.890975
H 0.401207 2.999875 -0.894171
H 1.824794 3.665501 0.000388
H 0.401505 2.999789 0.895373
H 5.456681 -0.910376 -0.000520
H 5.555965 0.660951 0.893713
H 5.556138 0.662661 -0.891914
H -3.324483 -0.489858 -2.170824
H -3.325387 -0.488995 2.171189
H -5.179228 1.190619 -2.174155
H -5.180125 1.191486 2.173081
H -6.114809 2.040532 -0.000900


