%chk=000075559.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075559

0 1
 O   -2.663100     -5.0000002E-04 -0.9232000    
 O    2.648400     -3.9999999E-04  0.9269000    
 O   -1.979400      5.0000002E-04   1.295600    
 O    2.000900      3.0000001E-04  -1.304000    
 N  -0.4300000     -5.0000002E-04 -0.4457000    
 N   0.4513000     -1.9999999E-04  0.4371000    
 C   -3.955000     -1.9999999E-04 -0.4954000    
 C    3.976200     -9.9999997E-05  0.4883000    
 C   -4.617300       1.208000     -0.2770000    
 C    4.603000       1.208000      0.2819000    
 C   -4.616900      -1.208200     -0.2750000    
 C    4.602700      -1.208100      0.2802000    
 C   -5.941200       1.208100      0.1622000    
 C    5.927200       1.208200     -0.1563000    
 C   -5.941000      -1.207800      0.1640000    
 C    5.926900      -1.207900     -0.1579000    
 C   -6.603000      3.9999999E-04  0.3826000    
 C    6.589200      3.0000001E-04 -0.3761000    
 C   -1.693500       0.000000      0.1013000    
 C    1.714600      9.9999997E-05 -0.1097000    
 H   -4.107700       2.152500     -0.4472000    
 H    4.087600       2.147800      0.4536000    
 H   -4.107200      -2.152900     -0.4436000    
 H    4.087200      -2.147900      0.4507000    
 H   -6.456700       2.148800      0.3324000    
 H    6.442800       2.148800     -0.3262000    
 H   -6.456500      -2.148200      0.3357000    
 H    6.442500      -2.148300     -0.3290000    
 H   -7.633900      5.0000002E-04  0.7245000    
 H    7.620300      3.9999999E-04 -0.7173000    


%chk=000075559-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000075559

0 1
O -2.758951 -0.000647 -0.690476
O 2.753657 -0.000455 0.690406
O -2.008098 0.002418 1.541723
O 2.002574 0.004120 -1.541749
N -0.495751 0.000487 -0.414986
N 0.490656 0.001558 0.415789
C -4.152891 -0.000461 -0.306790
C 4.146817 -0.000369 0.308340
C -4.814359 1.233298 -0.174190
C 4.808849 1.233137 0.175989
C -4.813164 -1.234161 -0.167817
C 4.807552 -1.233926 0.170116
C -6.197117 1.224991 0.117913
C 6.191807 1.224829 -0.114651
C -6.195934 -1.225673 0.124234
C 6.190521 -1.225682 -0.120477
C -6.887411 -0.000294 0.268189
C 6.882367 -0.000441 -0.263936
C -1.806540 0.001095 0.321368
C 1.801058 0.001677 -0.321542
H -4.262633 2.169612 -0.300584
H 4.256945 2.169535 0.301372
H -4.260551 -2.170597 -0.289341
H 4.254681 -2.170342 0.291017
H -6.731370 2.174595 0.226096
H 6.726022 2.174497 -0.222520
H -6.729271 -2.175220 0.237319
H 6.723740 -2.175387 -0.232862
H -7.958892 -0.000227 0.493781
H 7.954087 -0.000468 -0.488328


