%chk=000092526.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092526

0 1
 O   -1.585200      0.5832000      -1.424000    
 O   -8.717900      -2.259400      0.1159000    
 N   -2.512600       1.446400      0.5217000    
 N   -5.974600      0.1897000     -2.7899999E-02
 C    3.555700      6.0500000E-02 -0.3794000    
 C    4.847400     -1.9999999E-04  0.4405000    
 C    2.361100      0.6053000      0.4113000    
 C    6.058500     -0.4769000     -0.3685000    
 C    1.050300      0.5970000     -0.3827000    
 C    7.366000     -0.4686000      0.4267000    
 C  -0.1368000       1.073800      0.4544000    
 C    8.535300     -0.9624000     -0.4268000    
 C   -1.467600       1.004500     -0.2765000    
 C    9.844800     -0.9202000      0.3446000    
 C   -3.886200       1.457800      7.4900001E-02
 C   -4.584000      0.1465000      0.4052000    
 C   -6.658300      -1.055900      0.2918000    
 C   -8.095900      -1.021000     -0.2013000    
 H    3.715000      0.6910000      -1.262800    
 H    3.319000     -0.9456000     -0.7466000    
 H    4.701400     -0.6663000       1.299600    
 H    5.059800      0.9971000      0.8455000    
 H    2.580100       1.629100      0.7384000    
 H    2.233000      3.1000001E-03   1.319400    
 H    5.863100      -1.491500     -0.7374000    
 H    6.172500      0.1640000      -1.251700    
 H   0.8538000     -0.4195000     -0.7463000    
 H    1.153700       1.232100      -1.271100    
 H    7.570600      0.5487000      0.7814000    
 H    7.260700      -1.105600       1.313100    
 H  -0.2200000      0.4602000       1.359900    
 H   2.7200000E-02   2.111600      0.7689000    
 H    8.345500      -1.989300     -0.7599000    
 H    8.629100     -0.3416000      -1.325400    
 H    10.08030      0.1005000      0.6625000    
 H    10.66640      -1.278400     -0.2835000    
 H    9.795800      -1.555100       1.235100    
 H   -3.907800       1.648500      -1.004400    
 H   -4.379000       2.297100      0.5781000    
 H   -2.317500       1.765500       1.466200    
 H   -4.530200     -2.6400000E-02   1.487500    
 H   -4.056900     -0.6824000     -8.3800003E-02
 H   -6.016900      0.3589000      -1.032500    
 H   -6.656600      -1.231000       1.374900    
 H   -6.145500      -1.912300     -0.1645000    
 H   -8.659100     -0.2157000      0.2820000    
 H   -8.138400     -0.8824000      -1.286800    
 H   -9.633200      -2.210200     -0.2088000    


%chk=000092526-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000092526

0 1
O -1.620161 -0.944333 -0.965378
O -9.610485 -0.807531 0.443511
N -2.410481 0.854372 0.278128
N -6.079177 0.107776 -0.308573
C 3.684601 -0.092119 -0.303165
C 5.015407 -0.146944 0.480509
C 2.437814 -0.078599 0.609799
C 6.262570 -0.160249 -0.432000
C 1.113117 -0.014149 -0.180800
C 7.594506 -0.200269 0.350794
C -0.130236 0.014931 0.740136
C 8.841437 -0.216148 -0.562820
C -1.436070 -0.076768 -0.056064
C 10.167901 -0.249896 0.226990
C -3.729814 0.873627 -0.370677
C -4.794901 0.078890 0.420610
C -7.232302 -0.453178 0.430160
C -8.530341 -0.184861 -0.339227
H 3.676541 0.811474 -0.948091
H 3.625649 -0.962702 -0.988961
H 5.024178 -1.050085 1.126183
H 5.072832 0.724841 1.165972
H 2.502290 0.787142 1.302718
H 2.440758 -0.987943 1.247106
H 6.210362 -1.037085 -1.111009
H 6.248511 0.738000 -1.084527
H 1.023880 -0.888753 -0.852179
H 1.111001 0.883876 -0.831177
H 7.649118 0.678198 1.027842
H 7.609825 -1.097124 1.005194
H -0.090749 -0.862655 1.416518
H -0.113512 0.918753 1.381553
H 8.787919 -1.096197 -1.235976
H 8.822685 0.677845 -1.219316
H 10.261295 0.636792 0.882387
H 11.043015 -0.264369 -0.448665
H 10.222567 -1.148418 0.870497
H -3.599825 0.420770 -1.370814
H -4.072153 1.915794 -0.500678
H -2.216858 1.523670 1.024151
H -4.953273 0.551286 1.410185
H -4.404916 -0.950511 0.606233
H -5.982483 -0.325752 -1.238502
H -7.294585 0.047688 1.414119
H -7.153485 -1.548910 0.625348
H -8.676508 0.909431 -0.445807
H -8.470501 -0.633384 -1.356591
H -10.481066 -0.622022 0.011253


