%chk=000001267.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001267

0 1
 O   0.8132000     -0.5616000       1.960500    
 O   0.7691000       2.606200      -1.234200    
 N    1.460800      -2.316300      0.5083000    
 N   -1.772800      -1.567900       1.325100    
 N   -4.001000      0.2849000      -1.003800    
 N   -4.118900      -1.150400      -2.701900    
 N    2.247900       3.538400       1.962300    
 C  -0.6452000      -2.460800       1.557600    
 C  -0.4869000      -3.547700      0.4873000    
 C    1.015000      -3.673500      0.3162000    
 C   0.6121000      -1.624600       1.386900    
 C    2.671100      -1.808000     -3.2699998E-02
 C   -3.073500      -2.213000       1.483600    
 C   -4.186300      -1.253800       1.036200    
 C    2.780000     -0.4655000     -0.5090000    
 C   -4.131100     -0.9595000     -0.4296000    
 C    3.787000      -2.655700     -8.8000000E-02
 C    4.050200      2.0900000E-02 -0.9064000    
 C    1.679200      0.4074000     -0.6822000    
 C   -3.962700       1.584300     -0.3485000    
 C    5.022600      -2.170200     -0.5050000    
 C    5.158000     -0.8383000     -0.8876000    
 C    1.832900       1.737000      -1.091500    
 C    4.192100       1.351000      -1.345600    
 C   -4.201700      -1.819400      -1.511100    
 C   -2.582500       1.959400      0.1234000    
 C   -4.009700      0.1131000      -2.364600    
 C    3.094100       2.207600      -1.429000    
 C   -1.522500       2.127500     -0.7806000    
 C  -0.2516000       2.479200     -0.3158000    
 C   -2.348600       2.191900       1.487200    
 C  -3.3399999E-02   2.726300       1.041000    
 C   -1.084800       2.575900       1.941400    
 C    1.227800       3.175300       1.550300    
 H  -0.6417000      -2.880300       2.569900    
 H  -0.9314000      -3.229300     -0.4655000    
 H  -0.9599000      -4.492600      0.7714000    
 H    1.452300      -4.306400       1.096200    
 H    1.280000      -4.051000     -0.6761000    
 H   -1.697100      -1.170600      0.3888000    
 H   -3.226700      -2.468600       2.538200    
 H   -3.133600      -3.141100      0.9037000    
 H   -4.144900     -0.3387000       1.635500    
 H   -5.156300      -1.717900       1.255100    
 H    3.725000      -3.689100      0.2439000    
 H   0.6711000      3.5100002E-02 -0.5223000    
 H   -4.686600       1.558100      0.4736000    
 H   -4.324500       2.336400      -1.060300    
 H    5.887600      -2.827200     -0.5151000    
 H    6.139100     -0.4830000      -1.197100    
 H   -4.308200      -2.894600      -1.482900    
 H    5.168800       1.731300      -1.640000    
 H   -3.935600      0.9429000      -3.054500    
 H    3.232500       3.229400      -1.770800    
 H   -1.678200       1.970600      -1.844800    
 H   -3.155000       2.083900       2.208600    
 H  -0.9432000       2.762100       3.003700    


%chk=000001267-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001267

0 1
O 0.834303 -0.645799 2.087282
O 0.730279 2.516209 -1.286206
N 1.535422 -2.327263 0.564859
N -1.817393 -1.697224 1.245232
N -4.182219 0.401502 -0.993436
N -4.288449 -0.994875 -2.782112
N 2.336361 3.570445 1.852781
C -0.661472 -2.569487 1.489709
C -0.409993 -3.706976 0.440792
C 1.121292 -3.711218 0.206843
C 0.637436 -1.715619 1.454727
C 2.794259 -1.792429 0.128581
C -3.153569 -2.297183 1.384688
C -4.232588 -1.251091 1.006221
C 2.864909 -0.471729 -0.456455
C -4.215716 -0.909426 -0.466691
C 3.944966 -2.590053 0.196255
C 4.144512 0.002096 -0.946316
C 1.721524 0.373216 -0.597539
C -4.071090 1.671647 -0.250980
C 5.198351 -2.115041 -0.291063
C 5.298945 -0.839038 -0.848675
C 1.854783 1.642670 -1.151863
C 4.220236 1.306696 -1.543755
C -4.282472 -1.741731 -1.593417
C -2.652624 2.019949 0.200751
C -4.227488 0.289419 -2.385887
C 3.099224 2.126893 -1.648179
C -1.586167 2.060858 -0.732180
C -0.292249 2.417102 -0.313063
C -2.396549 2.331501 1.557136
C -0.033563 2.754216 1.049936
C -1.103306 2.695373 1.978401
C 1.269923 3.180427 1.479229
H -0.765173 -2.992974 2.508119
H -0.932784 -3.447181 -0.498369
H -0.775040 -4.692052 0.775772
H 1.627657 -4.449742 0.860261
H 1.399851 -3.930145 -0.837827
H -1.727496 -1.175707 0.361400
H -3.298148 -2.603983 2.439372
H -3.304789 -3.209609 0.755545
H -4.057364 -0.351796 1.624226
H -5.225884 -1.653638 1.283968
H 3.885758 -3.588014 0.643978
H 0.747891 0.044342 -0.236798
H -4.745989 1.642599 0.622266
H -4.451700 2.463530 -0.923153
H 6.080813 -2.758858 -0.216331
H 6.260519 -0.468245 -1.221496
H -4.343547 -2.827950 -1.618709
H 5.190740 1.659906 -1.910192
H -4.227035 1.156084 -3.044449
H 3.151081 3.131714 -2.075835
H -1.741177 1.809407 -1.786651
H -3.209129 2.286356 2.290823
H -0.905475 2.931420 3.027874


