%chk=000088377.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088377

0 1
 O    2.760600      0.9037000      0.9303000    
 O    2.804900      0.7744000      -1.367500    
 O   -4.004000     -0.9683000      0.2407000    
 O   0.4331000      -2.987000      6.6200003E-02
 O    2.230000      -1.742100     -0.1358000    
 N   0.9862000      -1.867800     -4.4900000E-02
 N   -4.241000       1.307400      8.6900003E-02
 C   0.7408000      0.5692000     -0.1918000    
 C   0.1741000     -0.6996000     -6.9300003E-02
 C   -2.027800      0.2918000      9.3999999E-03
 C   -1.210300     -0.8383000      3.1300001E-02
 C  -7.6700002E-02   1.699100     -0.2135000    
 C   -1.460900       1.560400     -0.1130000    
 C    2.183100      0.7542000     -0.2995000    
 C   -3.471200      0.1481000      0.1140000    
 C    4.179100       1.094900      0.9565000    
 H   -1.667400      -1.820400      0.1269000    
 H   0.3541000       2.692900     -0.3085000    
 H   -2.033000       2.480000     -0.1364000    
 H   -3.891100       2.251900     -8.2999999E-03
 H   -5.250600       1.234400      0.1654000    
 H    4.445900       2.010000      0.4197000    
 H    4.684800      0.2289000      0.5192000    
 H    4.490000       1.194700       1.999700    


%chk=000088377-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088377

0 1
O 2.891364 0.462688 0.844325
O 2.744661 1.906964 -0.985314
O -3.953262 -0.976737 0.749952
O 0.715540 -2.675069 0.861121
O 2.069618 -1.712622 -0.705450
N 1.058568 -1.699695 0.094270
N -4.434740 1.068282 -0.228567
C 0.746628 0.798542 -0.135491
C 0.193025 -0.488046 0.088013
C -2.074621 0.403480 0.081066
C -1.189813 -0.691194 0.220819
C -0.148924 1.883840 -0.274358
C -1.542144 1.692535 -0.173981
C 2.217494 1.103992 -0.182371
C -3.550946 0.107362 0.230921
C 4.367266 0.618274 0.853289
H -1.596010 -1.687070 0.421683
H 0.266486 2.880466 -0.451593
H -2.195997 2.567301 -0.258818
H -4.144675 1.897841 -0.741134
H -5.431367 0.880474 -0.122125
H 4.640243 1.685744 0.814432
H 4.793295 0.092038 -0.016876
H 4.691013 0.153112 1.793886


