%chk=000037814.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037814

0 1
 O   -1.556200       3.650600     -9.6199997E-02
 N  -9.7499996E-02 -0.4352000     -0.3371000    
 N    4.382000      -2.286800      0.5314000    
 C  -0.5724000      0.8312000     -5.6000002E-02
 C   -1.937400      0.6873000      0.1841000    
 C   -1.095500      -1.375200     -0.2779000    
 C   -2.267300     -0.7016000      4.5800000E-02
 C    1.183800     -0.8143000     -0.9099000    
 C   -2.921900       1.763600      0.5138000    
 C   0.2942000       2.028800     -6.2199999E-02
 C    2.144500      -1.365200      0.1434000    
 C   -2.266500       3.048400      0.9881000    
 C   -3.460600      -1.446300      0.1624000    
 C   -1.045500      -2.757600     -0.4908000    
 C  -0.2195000       3.339900     -9.4200000E-02
 C    3.485200      -1.744200     -0.4822000    
 C   -3.430300      -2.830000     -4.5699999E-02
 C   -2.238500      -3.474300     -0.3672000    
 C    1.696100       1.887600     -6.1900001E-02
 C   0.6336000       4.449400     -0.1857000    
 C   -4.690000      -3.621100      7.7100001E-02
 C    2.544900       2.997300     -0.1250000    
 C    2.013400       4.278300     -0.1957000    
 C    5.657600      -2.683100     -6.7800000E-02
 C    3.763700      -3.427500       1.209400    
 H   0.9955000      -1.594200      -1.660400    
 H    1.583000     -8.6000003E-03  -1.530400    
 H   -3.520900       1.963600     -0.3834000    
 H   -3.601100       1.405900       1.296500    
 H    2.278400     -0.7087000       1.009600    
 H    1.655700      -2.257700      0.5508000    
 H   -3.048200       3.758400       1.281200    
 H   -1.631600       2.898800       1.872500    
 H   -4.393100     -0.9459000      0.4097000    
 H  -0.1281000      -3.280400     -0.7374000    
 H    3.934200     -0.8462000     -0.9245000    
 H    3.324400      -2.463900      -1.295800    
 H   -2.221700      -4.549900     -0.5287000    
 H    2.237200      0.9802000      8.5400000E-02
 H   0.2217000       5.454500     -0.2345000    
 H   -5.372300      -3.167700      0.8042000    
 H   -5.195400      -3.674600     -0.8923000    
 H   -4.485100      -4.639900      0.4233000    
 H    3.622200       2.858400     -0.1036000    
 H    2.670500       5.140900     -0.2490000    
 H    6.134700      -1.826800     -0.5577000    
 H    5.536400      -3.481500     -0.8090000    
 H    6.354800      -3.029700      0.7032000    
 H    4.501700      -3.942300       1.837300    
 H    3.357800      -4.165700      0.5079000    
 H    2.980700      -3.113700       1.906800    


%chk=000037814-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000037814

0 1
O -1.611887 3.646901 -0.450400
N -0.044374 -0.422413 -0.197354
N 4.525775 -2.509658 0.363293
C -0.591573 0.882285 0.050065
C -1.985263 0.746342 0.231368
C -1.089469 -1.355989 -0.157713
C -2.308167 -0.656281 0.118423
C 1.261910 -0.777198 -0.789630
C -3.036396 1.805290 0.444133
C 0.258819 2.087872 0.095782
C 2.205935 -1.532489 0.175973
C -2.494190 3.215730 0.667510
C -3.528963 -1.378330 0.205440
C -1.077860 -2.751514 -0.384832
C -0.240743 3.390954 -0.233176
C 3.479431 -2.003977 -0.555951
C -3.535236 -2.773501 0.001133
C -2.303145 -3.440105 -0.299097
C 1.642822 2.018829 0.447028
C 0.617967 4.504982 -0.348817
C -4.823430 -3.576139 0.089664
C 2.499508 3.133550 0.361030
C 1.996090 4.380352 -0.077354
C 5.818860 -2.691377 -0.329207
C 4.123132 -3.729794 1.092633
H 1.065582 -1.413900 -1.676472
H 1.745817 0.141250 -1.159902
H -3.708104 1.821626 -0.438018
H -3.677516 1.542624 1.313168
H 2.506580 -0.883972 1.019734
H 1.662374 -2.389634 0.613045
H -3.316312 3.951456 0.679663
H -1.928970 3.284865 1.617355
H -4.468576 -0.855209 0.421034
H -0.155198 -3.294141 -0.615400
H 3.913010 -1.144898 -1.106325
H 3.199188 -2.772562 -1.327609
H -2.318412 -4.524607 -0.465318
H 2.046048 1.078218 0.829428
H 0.171963 5.463890 -0.631019
H -5.692087 -2.923736 0.285731
H -5.022778 -4.126909 -0.849283
H -4.778713 -4.326190 0.902579
H 3.552627 3.029120 0.643118
H 2.655570 5.250131 -0.166905
H 6.129047 -1.739171 -0.795638
H 5.789977 -3.475604 -1.129000
H 6.593937 -2.981532 0.402607
H 4.942399 -4.039781 1.765308
H 3.888822 -4.590556 0.413517
H 3.235472 -3.531802 1.716359


