%chk=000009669.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000009669

0 1
 O   -5.081600       1.453300      0.3456000    
 N    1.452100     -0.9441000      0.8841000    
 C   -1.202400      -1.604500     -0.1653000    
 C   7.5000003E-02  -1.604700      -1.067900    
 C    1.066100     -0.5679000     -0.4910000    
 C  -0.7963000      -1.924500       1.297100    
 C   0.4603000      0.8388000     -0.6734000    
 C   -1.830800     -0.1938000     -0.1836000    
 C   0.3308000      -1.024100       1.821600    
 C   -1.022100      0.9440000     -0.4033000    
 C   -2.193400      -2.682400     -0.6591000    
 C   0.7608000      -2.970400      -1.242900    
 C    2.536900     -0.1302000       1.423800    
 C   -3.197900      9.9999998E-03  8.2800001E-02
 C   -1.596200       2.227500     -0.3986000    
 C   -3.754100       1.291300      9.1200002E-02
 C   -2.954900       2.399800     -0.1545000    
 C    3.687900     -4.6500001E-02  0.4647000    
 C    4.222100       1.050700     -0.1054000    
 C    5.380400       1.063300      -1.062300    
 C    3.657200       2.414300      0.1963000    
 H  -0.2114000      -1.281600      -2.080600    
 H    1.950000     -0.6160000      -1.138500    
 H  -0.4707000      -2.970200       1.371200    
 H   -1.661100      -1.832400       1.967400    
 H   0.6180000       1.141100      -1.718000    
 H   0.9841000       1.574100     -5.6699999E-02
 H  -6.3000001E-02 -2.7700000E-02   2.056600    
 H   0.6781000      -1.446600       2.773100    
 H   -1.743600      -3.680300     -0.6614000    
 H   -3.073500      -2.764900     -1.3000000E-02
 H   -2.540000      -2.464900      -1.675800    
 H    1.009600      -3.444800     -0.2896000    
 H   0.1296000      -3.659200      -1.812400    
 H    1.692100      -2.860000      -1.809900    
 H    2.160700      0.8435000       1.741300    
 H    2.919100     -0.6102000       2.334200    
 H   -3.855500     -0.8265000      0.3003000    
 H  -0.9774000       3.102800     -0.5829000    
 H   -3.373900       3.402000     -0.1525000    
 H    4.144800      -1.004900      0.2166000    
 H   -5.295700       2.401600      0.3135000    
 H    5.082700       1.512100      -2.015300    
 H    5.741700      5.0400000E-02  -1.268000    
 H    6.214400       1.638500     -0.6477000    
 H    3.084800       2.779100     -0.6630000    
 H    4.478100       3.120100      0.3710000    
 H    3.026800       2.477900       1.082700    


%chk=000009669-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000009669

0 1
O -5.428772 1.029811 0.509092
N 1.379577 -0.709961 0.772097
C -1.263311 -1.598728 -0.173895
C -0.018619 -1.499621 -1.131814
C 0.914338 -0.377163 -0.604868
C -0.755368 -1.875595 1.282438
C 0.198567 0.995918 -0.762262
C -1.999741 -0.235836 -0.175351
C 0.283045 -0.842000 1.759999
C -1.287919 0.979112 -0.417176
C -2.196579 -2.755067 -0.609275
C 0.765114 -2.814154 -1.336166
C 2.499978 0.128678 1.267771
C -3.380097 -0.164351 0.134049
C -1.984681 2.210171 -0.353573
C -4.053583 1.072152 0.194984
C -3.359365 2.278721 -0.051294
C 3.737437 -0.005677 0.404195
C 4.559526 0.982829 -0.052247
C 5.792165 0.647057 -0.878048
C 4.360940 2.467321 0.206239
H -0.394713 -1.171487 -2.124888
H 1.826726 -0.351034 -1.230728
H -0.302757 -2.884885 1.314628
H -1.618621 -1.876389 1.975923
H 0.317732 1.319129 -1.817613
H 0.716479 1.765932 -0.155314
H -0.222794 0.133858 1.965929
H 0.723525 -1.181608 2.717924
H -1.650248 -3.713847 -0.602635
H -3.052605 -2.874168 0.078502
H -2.595903 -2.588481 -1.626908
H 1.182067 -3.187254 -0.385527
H 0.146084 -3.605349 -1.794028
H 1.619050 -2.630606 -2.015968
H 2.212945 1.202341 1.390641
H 2.735715 -0.239999 2.288767
H -3.967444 -1.064672 0.331471
H -1.433607 3.140197 -0.542533
H -3.875033 3.246888 -0.005972
H 3.986555 -1.048802 0.156314
H -5.810188 1.942294 0.525163
H 5.749787 1.138511 -1.870820
H 5.897499 -0.440226 -1.035598
H 6.714652 1.013582 -0.384489
H 4.402338 3.035213 -0.744236
H 5.174687 2.864315 0.845841
H 3.404120 2.695830 0.703762


