%chk=000088355.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088355

0 1
 O    4.708900      -2.422200       1.092100    
 O    2.156500       2.674400       3.199100    
 O    4.807400       3.659700      -2.497900    
 N    3.509000       1.329700      4.5299999E-02
 C   -3.904100     -0.5075000      5.5900000E-02
 C   -2.856300      -1.100400     -0.8916000    
 C   -5.271200     -0.3057000     -0.6015000    
 C   -1.468900      -1.232800     -0.2543000    
 C   -6.272900      0.3095000      0.3798000    
 C  -0.4300000      -1.837000      -1.206900    
 C   -7.628700      0.5467000     -0.2892000    
 C   0.9404000      -1.988000     -0.5956000    
 C    4.114400      2.9800000E-02 -0.2467000    
 C    3.134900      -1.091000     -0.1309000    
 C    1.867400     -0.9506000     -0.6957000    
 C   -8.677600       1.133500      0.6579000    
 C    3.353400       1.507400       1.488400    
 C    4.319200       2.408200     -0.5189000    
 C    1.281100      -3.166000      6.9300003E-02
 C    3.475600      -2.268900      0.5341000    
 C    2.548600      -3.306500      0.6341000    
 C   -10.00510       1.437400     -1.9600000E-02
 C    2.285700       2.547100       1.789100    
 C    4.012300       2.593300      -1.996400    
 H   -4.012300      -1.164900      0.9274000    
 H   -3.539900      0.4574000      0.4304000    
 H   -2.779600     -0.4677000      -1.784400    
 H   -3.195900      -2.087000      -1.229900    
 H   -5.650400      -1.269200     -0.9626000    
 H   -5.162600      0.3480000      -1.475300    
 H   -1.128000     -0.2443000      7.9000004E-02
 H   -1.544400      -1.855300      0.6464000    
 H   -5.882600       1.261200      0.7600000    
 H   -6.400200     -0.3562000       1.241900    
 H  -0.7773000      -2.818600      -1.555100    
 H  -0.3550000      -1.217500      -2.110200    
 H   -7.495000       1.225400      -1.140800    
 H   -8.005200     -0.4001000     -0.6956000    
 H    4.997300     -0.1213000      0.3879000    
 H    4.486600     -1.4500000E-02  -1.277900    
 H    1.593900     -4.1700002E-02  -1.226500    
 H   -8.289700       2.058800       1.100300    
 H   -8.851300      0.4346000       1.484800    
 H    3.032200      0.5780000       1.977000    
 H    4.302000       1.771600       1.975600    
 H    4.119400       3.371500     -3.4499999E-02
 H    5.393800       2.238600     -0.3648000    
 H   0.5666000      -3.980400      0.1553000    
 H    2.800300      -4.229400       1.149800    
 H   -9.874000       2.166000     -0.8259000    
 H   -10.71500       1.851900      0.7029000    
 H   -10.44230      0.5287000     -0.4454000    
 H    1.316300       2.238600       1.382400    
 H    2.533100       3.534400       1.390300    
 H    2.958200       2.850500      -2.146900    
 H    4.242700       1.701800      -2.586300    
 H    4.762100      -3.299500       1.508700    
 H    1.459400       3.332100       3.363800    
 H    4.583700       3.764800      -3.438400    


%chk=000088355-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088355

0 1
O 4.846730 -2.575093 1.061437
O 0.991306 2.966878 2.361589
O 5.419301 3.515128 -2.258260
N 3.520521 1.350764 0.129204
C -3.795343 -0.463721 0.102706
C -2.771559 -1.013633 -0.916053
C -5.186786 -0.192269 -0.512600
C -1.379627 -1.275371 -0.300080
C -6.212284 0.352141 0.507460
C -0.357231 -1.838071 -1.326714
C -7.603040 0.627195 -0.107659
C 1.020835 -2.067007 -0.723264
C 4.168460 0.018925 0.200538
C 3.192562 -1.143055 0.043754
C 1.925404 -0.986715 -0.557378
C -8.629081 1.167902 0.914471
C 2.781461 1.706412 1.366107
C 4.432677 2.413969 -0.357973
C 1.421111 -3.346607 -0.268215
C 3.562448 -2.441444 0.483530
C 2.685586 -3.538150 0.332040
C -10.014713 1.443709 0.291393
C 1.571237 2.598037 1.058389
C 4.445496 2.471213 -1.891650
H -3.899757 -1.183345 0.941402
H -3.401858 0.474299 0.547711
H -2.670953 -0.297467 -1.758962
H -3.161937 -1.955752 -1.355593
H -5.578383 -1.129791 -0.960328
H -5.082743 0.530563 -1.349002
H -0.978803 -0.334733 0.130536
H -1.472346 -1.986663 0.545407
H -5.819698 1.288093 0.957858
H -6.318260 -0.372323 1.342111
H -0.754499 -2.786791 -1.738875
H -0.286661 -1.127194 -2.174633
H -7.499290 1.354384 -0.940342
H -7.996398 -0.307542 -0.559779
H 4.741737 -0.117491 1.146982
H 4.921676 -0.040608 -0.609976
H 1.659603 0.020796 -0.899292
H -8.233938 2.099856 1.368220
H -8.734131 0.439333 1.744398
H 2.414929 0.778543 1.838293
H 3.426251 2.224426 2.113421
H 4.090662 3.393620 0.020629
H 5.477355 2.278362 0.005326
H 0.744240 -4.201653 -0.384202
H 2.987230 -4.537235 0.674754
H -9.943478 2.196554 -0.516382
H -10.730374 1.822801 1.044167
H -10.442024 0.522075 -0.147339
H 0.845705 2.033456 0.436080
H 1.888092 3.503546 0.497574
H 3.427778 2.717127 -2.259501
H 4.742145 1.486260 -2.311397
H 4.993821 -3.504448 1.366435
H 0.187298 3.525760 2.218635
H 5.468437 3.588442 -3.243809


