%chk=000148087.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148087

0 1
 O   -1.498200       2.198600      7.9700001E-02
 O    1.497500      -2.198900     -8.2900003E-02
 O   -4.935600      0.1120000      0.5788000    
 O    4.935500     -0.1124000     -0.5788000    
 O   -3.622300      0.6963000      -1.211700    
 O    3.622400     -0.6959000       1.212100    
 N    1.067100       2.499600     -0.6483000    
 N   -1.067100      -2.499600      0.6488000    
 N   -2.716100     -0.1605000      0.7498000    
 N    2.716200      0.1604000     -0.7496000    
 C    2.299900       2.946900     -8.7000001E-03
 C   0.9802000       3.508600      0.4022000    
 C   -2.299800      -2.946900      9.2000002E-03
 C  -0.9801000      -3.508600     -0.4015000    
 C   0.6238000       1.237400     -0.3465000    
 C  -0.6237000      -1.237400      0.3470000    
 C   -1.397400     -0.1426000      0.3949000    
 C    1.397400      0.1426000     -0.3944000    
 C  -0.8085000       1.181200      4.4500001E-02
 C   0.8084000      -1.181300     -4.4700000E-02
 C   -3.742100      0.2579000     -7.1800001E-02
 C    3.742100     -0.2582000      7.1900003E-02
 C   -6.099500      0.5090000     -0.1549000    
 C    6.099600     -0.5087000      0.1551000    
 C   -6.610600     -0.6747000     -0.9620000    
 C   -7.149600       1.029300      0.8149000    
 C    6.610700      0.6754000      0.9614000    
 C    7.149500      -1.029600     -0.8145000    
 H    2.786100       2.316600      0.7211000    
 H    2.929100       3.533300     -0.6615000    
 H   0.6963000       4.482500      3.2000002E-02
 H   0.5825000       3.203200       1.359800    
 H   -2.929000      -3.533200      0.6620000    
 H   -2.786000      -2.316700     -0.7206000    
 H  -0.5827000      -3.203400      -1.359300    
 H  -0.6963000      -4.482500     -3.1399999E-02
 H   -2.987600     -0.7951000       1.496600    
 H    2.987600      0.7949000      -1.496400    
 H   -5.860600       1.334200     -0.8376000    
 H    5.860800      -1.333600      0.8384000    
 H   -5.850300      -1.022500      -1.669200    
 H   -7.511600     -0.4124000      -1.525000    
 H   -6.841100      -1.522500     -0.3074000    
 H   -7.422500      0.2595000       1.545100    
 H   -8.054000       1.351600      0.2899000    
 H   -6.754500       1.877100       1.385000    
 H    5.850400       1.023700       1.668500    
 H    7.511800      0.4135000       1.524500    
 H    6.841100       1.522800      0.3062000    
 H    6.754300      -1.877800      -1.384000    
 H    8.054000      -1.351500     -0.2896000    
 H    7.422200     -0.2604000      -1.545300    


%chk=000148087-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000148087

0 1
O -1.194013 2.145648 1.209539
O 1.194335 -2.150412 -1.203879
O -5.027325 0.347423 0.491596
O 5.028105 -0.349146 -0.489192
O -3.825116 -0.473304 -1.365196
O 3.828778 0.479038 1.366170
N 1.369083 2.419859 0.313022
N -1.370415 -2.423561 -0.310854
N -2.800093 0.003249 0.717081
N 2.800071 -0.009706 -0.711486
C 2.609565 3.149049 0.606821
C 1.237671 3.614375 1.142324
C -2.612643 -3.148048 -0.608843
C -1.241429 -3.615417 -1.144405
C 0.810109 1.192479 0.213596
C -0.809917 -1.197077 -0.208478
C -1.426598 -0.056372 0.319698
C 1.427079 0.051123 -0.313077
C -0.661526 1.141114 0.611030
C 0.661800 -1.146099 -0.604771
C -3.863826 -0.075161 -0.170086
C 3.865451 0.074948 0.173008
C -6.303512 0.284413 -0.300855
C 6.305943 -0.280707 0.300156
C -6.879063 -1.136319 -0.208526
C -7.207088 1.360731 0.305210
C 6.879341 1.140378 0.199895
C 7.209605 -1.358607 -0.302962
H 3.305239 2.663935 1.297466
H 3.057355 3.685212 -0.238003
H 0.736971 4.472735 0.682106
H 1.010100 3.461653 2.201802
H -3.063077 -3.685999 0.233407
H -3.306014 -2.658135 -1.298461
H -1.012199 -3.459569 -2.203069
H -0.743666 -4.476779 -0.686625
H -2.983047 0.565711 1.555809
H 2.981648 -0.577443 -1.547066
H -6.044736 0.520005 -1.349876
H 6.049827 -0.511782 1.350837
H -6.181758 -1.868866 -0.649828
H -7.833818 -1.194677 -0.762794
H -7.069888 -1.409031 0.844639
H -7.418664 1.140795 1.366517
H -8.166569 1.398555 -0.241736
H -6.728523 2.352712 0.243511
H 6.182130 1.874017 0.639506
H 7.835381 1.202583 0.751527
H 7.067221 1.408492 -0.854983
H 6.732906 -2.351077 -0.234932
H 8.170671 -1.392051 0.241465
H 7.417837 -1.143686 -1.365954


