%chk=000036597.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036597

0 1
 O    1.426200     -0.9813000     -0.2816000    
 O  -0.9170000      -2.194500     -0.5302000    
 O  -0.7992000       3.281500      0.2214000    
 O    1.741800       3.057900      0.2813000    
 O    6.137300      -1.508800     -0.1927000    
 O   -5.837700     -0.6765000     -0.4975000    
 O   -3.484200      -2.020000     -0.5991000    
 O   -3.350600       3.271400      0.1298000    
 O  -0.9979000      -2.466500       1.793500    
 C   0.3402000       1.190200     -2.3600001E-02
 C   0.3055000     -0.1901000     -0.2132000    
 C   -2.114500     -0.1076000     -0.2879000    
 C   -2.073900       1.275700     -9.7599998E-02
 C    2.835100      0.9873000      3.5700001E-02
 C  -0.9233000     -0.8415000     -0.3457000    
 C  -0.8440000       1.930800      3.5500001E-02
 C    1.647600       1.851600      0.1128000    
 C    2.655100     -0.3818000     -0.1574000    
 C    4.119400       1.525100      0.1527000    
 C   -3.406600     -0.8087000     -0.4296000    
 C   -3.323400       2.057900     -3.5200000E-02
 C    3.768400      -1.221000     -0.2342000    
 C    5.227900      0.6816000      7.4800000E-02
 C    5.053000     -0.6888000     -0.1183000    
 C   -4.644900      4.9000001E-03 -0.3619000    
 C   -4.598700       1.326500     -0.1800000    
 C    4.397500       2.978800      0.3605000    
 C  -0.9596000      -2.932000      0.6623000    
 C    5.887000      -2.899300     -0.3912000    
 C   -6.317600      -1.102600      0.7625000    
 C  -0.9491000      -4.400000      0.3543000    
 H    3.571600      -2.277600     -0.3850000    
 H    6.237300       1.076800      0.1630000    
 H   -5.510700       1.913100     -0.1334000    
 H    4.023200       3.572100     -0.4800000    
 H    3.962600       3.328900       1.302200    
 H    5.472800       3.183000      0.4250000    
 H   -1.657400       3.691300      3.8800001E-02
 H    5.334900      -3.333200      0.4494000    
 H    6.859900      -3.400600     -0.4265000    
 H    5.396400      -3.087000      -1.352300    
 H   -5.608400      -1.776100       1.256300    
 H   -7.249200      -1.653900      0.6037000    
 H   -6.538900     -0.2490000       1.412900    
 H   -1.822600      -4.657100     -0.2498000    
 H  -0.9914000      -4.966900       1.288600    
 H  -2.6799999E-02  -4.659700     -0.1712000    


%chk=000036597-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000036597

0 1
O 1.435661 -0.837218 -0.099297
O -0.842338 -2.111004 -0.209684
O -0.804467 3.483026 0.123133
O 1.898632 3.318966 -0.042119
O 6.216672 -1.559664 -0.126630
O -5.965826 -0.364102 0.076636
O -3.570223 -1.961420 -0.170355
O -3.275504 3.520166 0.198303
O -1.580046 -2.558103 1.976039
C 0.418210 1.395618 -0.011171
C 0.320430 -0.013647 -0.059416
C -2.137261 0.001078 0.006952
C -2.078959 1.430590 0.068845
C 2.933959 1.133267 -0.057182
C -0.925168 -0.718857 -0.060288
C -0.822663 2.130931 0.060856
C 1.765720 2.056622 -0.035678
C 2.727936 -0.272314 -0.088375
C 4.302199 1.596281 -0.050808
C -3.459697 -0.699610 -0.033654
C -3.319438 2.213303 0.135532
C 3.759546 -1.227132 -0.113713
C 5.340656 0.649795 -0.074231
C 5.084983 -0.748198 -0.105643
C -4.693009 0.158665 0.073656
C -4.596845 1.535055 0.140778
C 4.670961 3.066254 -0.016959
C -1.298838 -2.978225 0.845533
C 6.015670 -3.013896 -0.156205
C -6.283281 -1.807267 0.222251
C -1.340118 -4.389014 0.328520
H 3.497363 -2.286377 -0.138266
H 6.384361 0.977447 -0.068418
H -5.500086 2.147081 0.206407
H 4.259431 3.605552 -0.887093
H 4.238214 3.571582 0.863272
H 5.768162 3.182516 -0.001210
H -1.819088 3.801633 0.172197
H 5.471267 -3.358035 0.743632
H 7.027811 -3.442254 -0.166480
H 5.468593 -3.320897 -1.067827
H -5.983344 -2.365761 -0.676757
H -7.376414 -1.811412 0.348477
H -5.782957 -2.234982 1.105587
H -2.226821 -4.486401 -0.323138
H -1.421856 -5.095805 1.166693
H -0.449089 -4.609529 -0.280806


